Structures by: Daniliuc C. G.


Structures by: Daniliuc C. G.

Results: 673


#NameUnit Cell
1508770C22H22F6N2
Organic letters (2012) 14, 23 5944-5947
a=14.5477(6)
b=9.8838(3)
c=14.5179(7)
α= 90.00
β= 107.769(3)
γ= 90.00
V = 1987.89(14)
1508771C20H22Br2N2
Organic letters (2012) 14, 23 5944-5947
a=15.0501(6)
b=30.2465(8)
c=8.6794(2)
α= 90.00
β= 103.939(2)
γ= 90.00
V = 3834.6(2)
1508772C20H22N4O4
Organic letters (2012) 14, 23 5944-5947
a=17.6875(4)
b=17.6875(4)
c=26.5075(7)
α= 90.00
β= 90.00
γ= 90.00
V = 8292.8(3)
1513381C18H13NO
Macromolecules (2014) 47, 3 993
a=9.8789(8)
b=12.1070(7)
c=23.0938(6)
α= 104.855(3)
β= 98.818(3)
γ= 90.340(6)
V = 2635.3(3)
1513534C27H22NOP
Organic letters (2014) 16, 1 250-253
a=9.1458(2)
b=12.1107(2)
c=19.6005(3)
α= 100.663(1)
β= 99.955(1)
γ= 92.248(1)
V = 2095.69(7)
1513648C34H36BF10P
Chemical Science (2014) 5, 2 797
a=13.2615(8)
b=14.2777(9)
c=17.5650(15)
α= 101.998(4)
β= 96.776(6)
γ= 91.480(6)
V = 3226.1(4)
1513649C34H38BF10P
Chemical Science (2014) 5, 2 797
a=10.7438(4)
b=17.8343(5)
c=18.5450(5)
α= 90.00
β= 106.201(2)
γ= 90.00
V = 3412.26(19)
1513650C39H41BF10NP
Chemical Science (2014) 5, 2 797
a=10.8542(5)
b=13.8552(5)
c=14.0717(10)
α= 102.350(2)
β= 96.684(6)
γ= 111.631(3)
V = 1876.71(19)
1513651C22H35P
Chemical Science (2014) 5, 2 797
a=9.71840(10)
b=11.6807(2)
c=35.4816(5)
α= 90.00
β= 90.00
γ= 90.00
V = 4027.79(10)
1513652C39H41BF10NP
Chemical Science (2014) 5, 2 797
a=38.3733(7)
b=9.7770(2)
c=22.7086(6)
α= 90.00
β= 117.1950(10)
γ= 90.00
V = 7577.9(3)
1513653C41H37BCl2F15P
Chemical Science (2014) 5, 2 797
a=15.4992(3)
b=17.1040(3)
c=15.7066(3)
α= 90.00
β= 93.5550(10)
γ= 90.00
V = 4155.78(13)
1514123C38H58FeP2
The journal of physical chemistry. A (2014) 118, 12 2316-2331
a=13.1315(3)
b=9.8741(2)
c=13.7239(4)
α= 90.00
β= 103.615(1)
γ= 90.00
V = 1729.46(7)
1514124C38H46FeP2
The journal of physical chemistry. A (2014) 118, 12 2316-2331
a=13.2558(2)
b=9.2386(1)
c=13.4456(2)
α= 90.00
β= 99.992(1)
γ= 90.00
V = 1621.64(4)
1514125C39H48Cl2FeP2
The journal of physical chemistry. A (2014) 118, 12 2316-2331
a=13.4011(3)
b=21.5414(3)
c=48.6745(10)
α= 90.00
β= 90.00
γ= 90.00
V = 14051.3(5)
1514126C38H58FeP2
The journal of physical chemistry. A (2014) 118, 12 2316-2331
a=11.9515(3)
b=12.1683(3)
c=14.2621(4)
α= 110.6840(10)
β= 97.5660(10)
γ= 114.3890(10)
V = 1670.91(8)
1514655C39H17BF15P
Chemical Science (2013) 4, 6 2657
a=9.9184(2)
b=20.5507(4)
c=17.2472(4)
α= 90.00
β= 101.677(2)
γ= 90.00
V = 3442.74(13)
1514656C34H20BF10P
Chemical Science (2013) 4, 6 2657
a=8.3314(3)
b=23.9142(9)
c=14.7962(9)
α= 90.00
β= 90.618(4)
γ= 90.00
V = 2947.8(2)
1514657C44H26BF15NP
Chemical Science (2013) 4, 6 2657
a=13.8351(8)
b=11.5678(8)
c=30.569(3)
α= 90.00
β= 101.896(7)
γ= 90.00
V = 4787.2(6)
1514658C39H29BF10NP
Chemical Science (2013) 4, 6 2657
a=10.1806(5)
b=10.4896(3)
c=17.7612(8)
α= 94.693(3)
β= 95.330(5)
γ= 112.360(3)
V = 1732.34(13)
1514659C46H30BCl4F15NP
Chemical Science (2013) 4, 6 2657
a=17.6472(7)
b=14.6343(4)
c=18.4267(7)
α= 90.00
β= 103.288(2)
γ= 90.00
V = 4631.4(3)
1514660C39.5H30BClF10NP
Chemical Science (2013) 4, 6 2657
a=39.1199(4)
b=16.3061(2)
c=23.4811(4)
α= 90.00
β= 97.4210(10)
γ= 90.00
V = 14853.0(3)
1514842C30H27BF15O2PS
Chemical Science (2013) 4, 1 213
a=9.4942(4)
b=29.0008(13)
c=11.5368(5)
α= 90.00
β= 90.018(2)
γ= 90.00
V = 3176.5(2)
1514843C33H28BF10O2PS
Chemical Science (2013) 4, 1 213
a=13.2898(3)
b=13.3521(6)
c=22.5790(9)
α= 73.392(3)
β= 73.073(3)
γ= 83.328(4)
V = 3670.7(2)
1514844C36H32BF10O2PS
Chemical Science (2013) 4, 1 213
a=10.5993(4)
b=11.8650(4)
c=14.4165(9)
α= 92.700(3)
β= 95.322(2)
γ= 111.030(4)
V = 1678.66(14)
1515079C42H74I2Mn2O2
Chemical Science (2012) 3, 10 2972
a=9.2320(4)
b=9.9138(4)
c=13.3547(5)
α= 105.125(2)
β= 102.783(2)
γ= 100.418(2)
V = 1113.14(8)
1515080C68H122Mn5,2(C5H12)
Chemical Science (2012) 3, 10 2972
a=27.5131(8)
b=12.7588(4)
c=25.2896(7)
α= 90.00
β= 114.339(2)
γ= 90.00
V = 8088.5(4)
1515081C78H146Mn5
Chemical Science (2012) 3, 10 2972
a=27.4840(4)
b=12.7411(2)
c=25.2730(4)
α= 90.00
β= 114.331(2)
γ= 90.00
V = 8064.0(2)
1517664C27H45ClO
Organic letters (2014) 16, 18 4932-4935
a=62.156(3)
b=6.5176(3)
c=18.9764(8)
α= 90
β= 101.552(3)
γ= 90
V = 7531.8(6)
1517842C40H53BNP
Chem. Sci. (2014)
a=14.6590(9)
b=12.4208(4)
c=20.7836(9)
α= 90.00
β= 108.784(3)
γ= 90.00
V = 3582.7(3)
1517843C63H58B2F20P2
Chem. Sci. (2014)
a=14.7651(4)
b=17.3362(4)
c=23.4491(3)
α= 90.00
β= 90.00
γ= 90.00
V = 6002.3(2)
1517844C29H18BF10P
Chem. Sci. (2014)
a=10.0670(7)
b=11.7645(11)
c=13.4704(13)
α= 109.385(3)
β= 97.336(5)
γ= 114.390(5)
V = 1303.9(2)
1517845C35H30BF10P
Chem. Sci. (2014)
a=9.1195(3)
b=19.9550(5)
c=18.0470(5)
α= 90.00
β= 91.390(2)
γ= 90.00
V = 3283.22(16)
1517846C25H26BF10P
Chem. Sci. (2014)
a=25.4740(7)
b=12.5753(3)
c=19.1732(4)
α= 90.00
β= 109.881(2)
γ= 90.00
V = 5775.9(3)
1518279C24H20N2O2
Chem. Sci. (2015) 6, 2 1252
a=7.58000(10)
b=13.21490(10)
c=18.52820(10)
α= 90.00
β= 90.00
γ= 90.00
V = 1855.95(3)
1518492C32H22BCl3F4N2O2
Organic letters (2015) 17, 2 254-257
a=30.8526(5)
b=11.9970(2)
c=18.7562(3)
α= 90
β= 113.7440(10)
γ= 90
V = 6354.75(19)
1518493TOG579B
Organic letters (2015) 17, 2 254-257
a=8.5347(2)
b=14.9824(4)
c=10.2813(2)
α= 90
β= 96.6320(9)
γ= 90
V = 1305.88(5)
1518494C18H20N2O2S
Organic letters (2015) 17, 2 254-257
a=12.7796(3)
b=13.8018(4)
c=18.4448(5)
α= 90
β= 90
γ= 90
V = 3253.32(15)
1518649C17H17NO3
Organic letters (2015) 17, 3 664-667
a=8.9854(3)
b=18.5028(5)
c=9.4678(3)
α= 90.00
β= 109.249(2)
γ= 90.00
V = 1486.07(8)
1518650C25H22ClNO4
Organic letters (2015) 17, 3 664-667
a=8.5929(2)
b=9.9207(3)
c=13.6227(6)
α= 73.585(1)
β= 78.745(1)
γ= 86.593(1)
V = 1092.53(6)
1520452C24H17N4O
Chem. Sci. (2015) 6, 8 4712
a=3.9114(4)
b=20.5945(6)
c=22.4580(10)
α= 90.00
β= 91.758(6)
γ= 90.00
V = 1808.2(2)
1520453C28H19N4O
Chem. Sci. (2015) 6, 8 4712
a=11.7763(13)
b=5.8280(3)
c=16.1543(9)
α= 90.00
β= 104.773(6)
γ= 90.00
V = 1072.06(15)
1520454C32H26N4O
Chem. Sci. (2015) 6, 8 4712
a=7.4740(8)
b=9.2641(5)
c=35.8650(18)
α= 90.00
β= 91.227(5)
γ= 90.00
V = 2482.7(3)
1520455C36H28N4O
Chem. Sci. (2015) 6, 8 4712
a=11.2158(3)
b=10.0647(3)
c=24.8459(6)
α= 90.00
β= 97.414(2)
γ= 90.00
V = 2781.25(13)
1542534C19H18N2O3
Organic letters (2016) 18, 5 1206
a=18.7959(5)
b=22.7469(5)
c=8.0182(2)
α= 90
β= 90
γ= 90
V = 3428.17(15)
1542703C16H15F5O3S
Organic letters (2016) 18, 5 1012
a=5.5840(4)
b=11.7071(9)
c=12.0947(9)
α= 85.184(5)
β= 83.294(5)
γ= 87.881(5)
V = 782.18(10)
1542704C17H23Cl2F5O3S
Organic letters (2016) 18, 5 1012
a=10.0879(6)
b=13.4704(7)
c=16.5159(9)
α= 66.318(2)
β= 85.001(2)
γ= 89.698(2)
V = 2046.4(2)
1544993C49H32B2F22NO2P
Chem. Sci. (2017)
a=12.2342(14)
b=24.232(3)
c=18.5607(19)
α= 90
β= 100.311(7)
γ= 90
V = 5413.6(11)
1544994C30H23BF15N
Chem. Sci. (2017)
a=9.1176(12)
b=16.071(2)
c=19.360(2)
α= 90
β= 98.211(4)
γ= 90
V = 2807.7(6)
1544995C24H24BF10N
Chem. Sci. (2017)
a=9.6021(5)
b=9.8581(6)
c=13.1600(7)
α= 73.124(2)
β= 77.164(2)
γ= 81.941(2)
V = 1158.44(11)
1544996C38H25B2F20NO2
Chem. Sci. (2017)
a=14.4987(7)
b=11.0883(4)
c=23.6041(10)
α= 90
β= 106.5030(10)
γ= 90
V = 3638.4(3)
1544997C44H24B2F25NO2
Chem. Sci. (2017)
a=11.0648(2)
b=22.0848(4)
c=20.1904(4)
α= 90.00
β= 102.354(1)
γ= 90.00
V = 4819.56(16)
1544998C24H24BF10N3O2
Chem. Sci. (2017)
a=7.04320(10)
b=18.5654(4)
c=19.9939(4)
α= 90.00
β= 98.0220(10)
γ= 90.00
V = 2588.82(8)
1544999C26H28BF10N3O2
Chem. Sci. (2017)
a=11.4759(7)
b=11.5926(7)
c=20.7695(13)
α= 90
β= 95.877(2)
γ= 90
V = 2748.6(3)
1545000C32H30BF10N
Chem. Sci. (2017)
a=10.9697(2)
b=11.2538(2)
c=13.9662(4)
α= 93.564(1)
β= 101.334(1)
γ= 106.008(1)
V = 1612.53(6)
4030573C37H25BF15NSi2
The Journal of organic chemistry (2015) 80, 4 2240-2248
a=10.4022(6)
b=13.0301(8)
c=14.7160(8)
α= 109.281(4)
β= 95.936(5)
γ= 93.636(5)
V = 1862.52(19)
4030574C37H25BF15NSi2
The Journal of organic chemistry (2015) 80, 4 2240-2248
a=19.0787(6)
b=12.0494(2)
c=34.2690(12)
α= 90.00
β= 111.900(2)
γ= 90.00
V = 7309.5(4)
4030575C22H18F5NOSi
The Journal of organic chemistry (2015) 80, 4 2240-2248
a=13.0052(2)
b=7.36350(10)
c=20.9912(4)
α= 90.00
β= 101.8690(10)
γ= 90.00
V = 1967.22(6)
4030576C20H21F5OSSi2
The Journal of organic chemistry (2015) 80, 4 2240-2248
a=24.4029(8)
b=6.2523(2)
c=29.3312(10)
α= 90.00
β= 102.229(2)
γ= 90.00
V = 4373.6(3)
4030577C33H21BF15NSi2
The Journal of organic chemistry (2015) 80, 4 2240-2248
a=23.8836(7)
b=10.9631(3)
c=29.7545(6)
α= 90.00
β= 108.263(2)
γ= 90.00
V = 7398.4(3)
4030578C33H21BF15NSi2
The Journal of organic chemistry (2015) 80, 4 2240-2248
a=14.2884(2)
b=10.0454(2)
c=23.2090(5)
α= 90.00
β= 94.7950(10)
γ= 90.00
V = 3319.59(11)
4031041C36H46N2
The Journal of organic chemistry (2015) 80, 12 6062-6075
a=9.8962(2)
b=12.3956(2)
c=14.3686(3)
α= 103.7110(10)
β= 104.8680(10)
γ= 107.4070(10)
V = 1528.58(5)
4031042C25H25NO
The Journal of organic chemistry (2015) 80, 12 6062-6075
a=11.4645(2)
b=10.3142(2)
c=17.1773(3)
α= 90.00
β= 100.2070(10)
γ= 90.00
V = 1999.02(6)
4031043C33H34N2S
The Journal of organic chemistry (2015) 80, 12 6062-6075
a=10.9544(2)
b=15.5811(2)
c=16.2400(3)
α= 90.00
β= 93.0150(1)
γ= 90.00
V = 2768.03(8)
4031044C44.5H62AlN2
The Journal of organic chemistry (2015) 80, 12 6062-6075
a=10.36780(10)
b=20.1857(3)
c=38.4806(6)
α= 90.00
β= 95.3900(10)
γ= 90.00
V = 8017.66(19)
4031045C32H36N2O2
The Journal of organic chemistry (2015) 80, 12 6062-6075
a=14.0496(8)
b=9.4000(5)
c=21.4140(12)
α= 90.00
β= 104.563(5)
γ= 90.00
V = 2737.2(3)
4031046C38H58AlN3
The Journal of organic chemistry (2015) 80, 12 6062-6075
a=9.57260(10)
b=10.3245(2)
c=19.0030(3)
α= 89.1290(10)
β= 79.1110(10)
γ= 79.7430(10)
V = 1814.49(5)
4031047C36H46N2
The Journal of organic chemistry (2015) 80, 12 6062-6075
a=15.5641(2)
b=9.7761(2)
c=20.3018(3)
α= 90.00
β= 91.927(2)
γ= 90.00
V = 3087.30(9)
4031048C41H51AlN2S
The Journal of organic chemistry (2015) 80, 12 6062-6075
a=16.316(3)
b=18.957(4)
c=24.372(5)
α= 90.00
β= 93.41(3)
γ= 90.00
V = 7525(3)
4031049C41H51AlN2O
The Journal of organic chemistry (2015) 80, 12 6062-6075
a=24.3370(3)
b=14.4058(2)
c=23.6049(3)
α= 90.00
β= 116.2550(10)
γ= 90.00
V = 7421.96(18)
4031050C33H34N2O
The Journal of organic chemistry (2015) 80, 12 6062-6075
a=12.2472(2)
b=14.9329(2)
c=15.3099(2)
α= 90.00
β= 105.5680(10)
γ= 90.00
V = 2697.25(7)
4031051C24H30N2O
The Journal of organic chemistry (2015) 80, 12 6062-6075
a=9.5999(3)
b=21.4717(7)
c=21.4092(8)
α= 90.00
β= 103.025(2)
γ= 90.00
V = 4299.5(3)
4031052C30H41N3
The Journal of organic chemistry (2015) 80, 12 6062-6075
a=11.2789(2)
b=14.8836(2)
c=16.6853(3)
α= 108.907(1)
β= 93.118(1)
γ= 90.678(1)
V = 2644.64(8)
4031053C31H41N3O2
The Journal of organic chemistry (2015) 80, 12 6062-6075
a=13.3302(2)
b=17.4231(3)
c=13.1930(2)
α= 90.00
β= 112.8200(10)
γ= 90.00
V = 2824.28(8)
4031054C31H29N3O2
The Journal of organic chemistry (2015) 80, 12 6062-6075
a=11.7512(2)
b=13.6029(2)
c=16.0553(2)
α= 90.00
β= 90.00
γ= 90.00
V = 2566.45(7)
4031055C24H24N2O
The Journal of organic chemistry (2015) 80, 12 6062-6075
a=9.6606(5)
b=10.3697(4)
c=19.9040(11)
α= 90.00
β= 94.215(4)
γ= 90.00
V = 1988.54(17)
4031056C32H30N2O2
The Journal of organic chemistry (2015) 80, 12 6062-6075
a=35.9358(4)
b=10.7792(3)
c=13.7801(2)
α= 90.00
β= 105.5970(10)
γ= 90.00
V = 5141.29(17)
4031057C34H46AlN
The Journal of organic chemistry (2015) 80, 12 6062-6075
a=9.3621(2)
b=10.0342(2)
c=18.8087(5)
α= 91.1580(10)
β= 99.1020(10)
γ= 115.8810(10)
V = 1561.73(6)
4031748C4H8ClF2NO2
The Journal of organic chemistry (2015) 80, 24 12258-12264
a=4.77440(10)
b=16.1844(4)
c=8.8835(2)
α= 90.00
β= 96.4550(10)
γ= 90.00
V = 682.08(3)
4031936C19H16N4O
The Journal of organic chemistry (2016) 81, 7 2849-2863
a=21.9750(5)
b=7.9493(2)
c=19.2418(6)
α= 90.00
β= 104.9930(10)
γ= 90.00
V = 3246.84(15)
4031937C27H29N3
The Journal of organic chemistry (2016) 81, 7 2849-2863
a=9.3920(5)
b=9.6342(5)
c=13.7713(8)
α= 77.113(2)
β= 81.781(2)
γ= 65.015(5)
V = 1099.35(11)
4031938C20H23N3
The Journal of organic chemistry (2016) 81, 7 2849-2863
a=11.74710(10)
b=13.29100(10)
c=11.58740(10)
α= 90.00
β= 106.7490(10)
γ= 90.00
V = 1732.40(3)
4031939C17.5H19N4O0.5
The Journal of organic chemistry (2016) 81, 7 2849-2863
a=22.1401(7)
b=10.4147(4)
c=14.3555(7)
α= 90.00
β= 100.699(3)
γ= 90.00
V = 3252.6(2)
4031940C17H23N3
The Journal of organic chemistry (2016) 81, 7 2849-2863
a=9.08780(10)
b=9.20200(10)
c=9.5148(2)
α= 95.9240(10)
β= 110.6390(10)
γ= 96.7820(10)
V = 730.37(2)
4031941C19H15N3
The Journal of organic chemistry (2016) 81, 7 2849-2863
a=5.3908(4)
b=12.7036(8)
c=21.4042(16)
α= 90.00
β= 92.502(3)
γ= 90.00
V = 1464.42(18)
4031942C17H12N4
The Journal of organic chemistry (2016) 81, 7 2849-2863
a=14.52870(10)
b=5.13100(10)
c=18.09840(10)
α= 90.00
β= 106.7350(10)
γ= 90.00
V = 1292.04(3)
4031943C18H13N3
The Journal of organic chemistry (2016) 81, 7 2849-2863
a=12.3812(3)
b=5.65530(10)
c=18.7769(5)
α= 90.00
β= 92.8640(10)
γ= 90.00
V = 1313.11(5)
4031944C21H24N4O
The Journal of organic chemistry (2016) 81, 7 2849-2863
a=13.1740(6)
b=9.6470(4)
c=16.3830(7)
α= 90.00
β= 113.416(2)
γ= 90.00
V = 1910.63(15)
4031945C15H22N4
The Journal of organic chemistry (2016) 81, 7 2849-2863
a=17.2832(9)
b=10.5241(5)
c=16.7531(8)
α= 90.00
β= 102.000(5)
γ= 90.00
V = 2980.6(3)
4031946C14H8N2
The Journal of organic chemistry (2016) 81, 7 2849-2863
a=15.8339(4)
b=3.97490(10)
c=16.9483(4)
α= 90.00
β= 101.6280(10)
γ= 90.00
V = 1044.80(4)
4031947C20H22N4
The Journal of organic chemistry (2016) 81, 7 2849-2863
a=16.8777(4)
b=9.1711(2)
c=21.9473(6)
α= 90.00
β= 91.3460(10)
γ= 90.00
V = 3396.22(14)
4031948C13H14N2O
The Journal of organic chemistry (2016) 81, 7 2849-2863
a=15.6020(4)
b=12.9520(3)
c=11.0992(2)
α= 90.00
β= 103.3100(10)
γ= 90.00
V = 2182.65(9)
4064093C37H63B9N3O2Sc
Organometallics (2011) 30, 5 1122
a=10.7349(2)
b=17.5335(4)
c=22.1591(4)
α= 90.00
β= 100.874(2)
γ= 90.00
V = 4095.90(14)
4064094C37H63B9N3O2Y
Organometallics (2011) 30, 5 1122
a=10.7992(2)
b=17.4516(4)
c=22.4186(4)
α= 90.00
β= 99.785(2)
γ= 90.00
V = 4163.62(15)
4064095C37H64B9N4OSc
Organometallics (2011) 30, 5 1122
a=13.9306(4)
b=15.8819(4)
c=18.9486(4)
α= 90.00
β= 98.464(2)
γ= 90.00
V = 4146.61(18)
4064096C45H80B9N4O3Y
Organometallics (2011) 30, 5 1122
a=10.1838(4)
b=11.7374(4)
c=21.4661(8)
α= 96.415(3)
β= 92.025(3)
γ= 98.546(3)
V = 2517.97(16)
4064097C45H80B9LuN4O3
Organometallics (2011) 30, 5 1122
a=10.1178(4)
b=11.6476(4)
c=21.4015(10)
α= 96.897(4)
β= 92.090(4)
γ= 98.288(4)
V = 2474.01(18)
4064098C43H77B9N5O2Y
Organometallics (2011) 30, 5 1122
a=10.125(5)
b=12.243(5)
c=20.164(9)
α= 96.541(8)
β= 93.202(8)
γ= 106.821(8)
V = 2366.6(19)
4064099C40H70B9N4O2Y
Organometallics (2011) 30, 5 1122
a=38.348(6)
b=17.036(3)
c=17.959(3)
α= 90.00
β= 116.138(4)
γ= 90.00
V = 10533(3)
4078528C20H26Fe
Organometallics (2012) 31, 12 4480
a=13.5328(8)
b=6.8730(4)
c=17.8642(12)
α= 90.00
β= 104.134(6)
γ= 90.00
V = 1611.27(18)
4078529C21H26FeO
Organometallics (2012) 31, 12 4480
a=10.0070(2)
b=16.1642(2)
c=10.9946(2)
α= 90.00
β= 96.813(2)
γ= 90.00
V = 1765.87(5)