tris[2-tris(3,5-ditert-butyl-4-methoxy-phenyl)silylethynyl]phosphane

Systemtic Name: tris[2-tris(3,5-ditert-butyl-4-methoxy-phenyl)silylethynyl]phosphane Openeye Name: tris[2-tris(3,5-ditert-butyl-4-methoxy-phenyl)silylethynyl]phosphane CAS Name: tris[2-tris(3,5-ditert-butyl-4-methoxyphenyl)silylethynyl]phosphine IUPAC Name: tris[2-tris(3,5-ditert-butyl-4-methoxyphenyl)silylethynyl]phosphane Traditional Name: tris[2-tris(3,5-ditert-butyl-4-methoxy-phenyl)silylethynyl]phosphine Formula: C141H207O9PSi3 MolecularWeight: 2161.377141

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=CC(=C1OC)C(C)(C)C)[Si](C#CP(C#C[Si](C2=CC(=C(C(=C2)C(C)(C)C)OC)C(C)(C)C)(C3=CC(=C(C(=C3)C(C)(C)C)OC)C(C)(C)C)C4=CC(=C(C(=C4)C(C)(C)C)OC)C(C)(C)C)C#C[Si](C5=CC(=C(C(=C5)C(C)(C)C)OC)C(C)(C)C)(C6=CC(=C(C(=C6)C(C)(C)C)OC)C(C)(C)C)C7=CC(=C(C(=C7)C(C)(C)C)OC)C(C)(C)C)(C8=CC(=C(C(=C8)C(C)(C)C)OC)C(C)(C)C)C9=CC(=C(C(=C9)C(C)(C)C)OC)C(C)(C)C

Isomeric SMILES

CC(C)(C)C1=CC(=CC(=C1OC)C(C)(C)C)[Si](C#CP(C#C[Si](C2=CC(=C(C(=C2)C(C)(C)C)OC)C(C)(C)C)(C3=CC(=C(C(=C3)C(C)(C)C)OC)C(C)(C)C)C4=CC(=C(C(=C4)C(C)(C)C)OC)C(C)(C)C)C#C[Si](C5=CC(=C(C(=C5)C(C)(C)C)OC)C(C)(C)C)(C6=CC(=C(C(=C6)C(C)(C)C)OC)C(C)(C)C)C7=CC(=C(C(=C7)C(C)(C)C)OC)C(C)(C)C)(C8=CC(=C(C(=C8)C(C)(C)C)OC)C(C)(C)C)C9=CC(=C(C(=C9)C(C)(C)C)OC)C(C)(C)C

InChI

InChI=1S/C141H207O9PSi3/c1-124(2,3)97-70-88(71-98(115(97)142-55)125(4,5)6)152(89-72-99(126(7,8)9)116(143-56)100(73-89)127(10,11)12,90-74-101(128(13,14)15)117(144-57)102(75-90)129(16,17)18)67-64-151(65-68-153(91-76-103(130(19,20)21)118(145-58)104(77-91)131(22,23)24,92-78-105(132(25,26)27)119(146-59)106(79-92)133(28,29)30)93-80-107(134(31,32)33)120(147-60)108(81-93)135(34,35)36)66-69-154(94-82-109(136(37,38)39)121(148-61)110(83-94)137(40,41)42,95-84-111(138(43,44)45)122(149-62)112(85-95)139(46,47)48)96-86-113(140(49,50)51)123(150-63)114(87-96)141(52,53)54/h70-87H,1-63H3