chloranyl-[[7-[[chloranyl(dimethyl)silyl]methyl](C\{60}-I\{h})[5,6]fulleren-1-yl]methyl]-dimethyl-silane

Systemtic Name: chloranyl-[[7-[[chloranyl(dimethyl)silyl]methyl](C\{60}-I\{h})[5,6]fulleren-1-yl]methyl]-dimethyl-silane Openeye Name: chloro-[[4-[[chloro(dimethyl)silyl]methyl][60]fulleren-1-yl]methyl]-dimethyl-silane CAS Name: chloro-[[7-[[chloro(dimethyl)silyl]methyl]-1-(C\{60}-I\{h})[5,6]fullerenyl]methyl]-dimethylsilane IUPAC Name: chloro-[[7-[[chloro(dimethyl)silyl]methyl](C\{60}-I\{h})[5,6]fulleren-1-yl]methyl]-dimethylsilane Traditional Name: chloro-[[4-[[chloro(dimethyl)silyl]methyl]buckminsterfulleren-1-yl]methyl]-dimethyl-silane Formula: C66H16Cl2Si2 MolecularWeight: 935.91024

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C[Si](C)(CC12C3=C4C5=C6C7=C8C9=C%10C%11=C%12C%13=C%14C%10=C8C8=C6C6=C%10C8=C%14C8=C%14C%10=C(C1=C64)C1(C%14=C4C(=C%138)C6=C%12C8=C%10C%12=C%13C(=C%118)C9=C8C%13=C9C%11=C%12C%12=C%10C6=C4C4=C%12C(=C%11C3=C9C5=C87)C2=C41)C[Si](C)(C)Cl)Cl

Isomeric SMILES

C[Si](C)(CC12C3=C4C5=C6C7=C8C9=C%10C%11=C%12C%13=C%14C%10=C8C8=C6C6=C%10C8=C%14C8=C%14C%10=C(C1=C64)C1(C%14=C4C(=C%138)C6=C%12C8=C%10C%12=C%13C(=C%118)C9=C8C%13=C9C%11=C%12C%12=C%10C6=C4C4=C%12C(=C%11C3=C9C5=C87)C2=C41)C[Si](C)(C)Cl)Cl

InChI

InChI=1S/C66H16Cl2Si2/c1-69(2,67)5-65-59-51-42-35-22-15-9-10-12-8-7-11(9)20(22)26-24-13(7)17-14(8)25-27-21(12)23-16(10)19-18(15)29-37-30(19)39-36(23)43-41(27)45-32(25)34-28(17)33-31(24)44(40(26)42)55(59)57-46(33)47(34)58-56(45)60-52(43)49(39)54-50(37)53(48(51)38(29)35)61(65)62(54)66(60,6-70(3,4)68)64(58)63(57)65/h5-6H2,1-4H3