Geometry & MOs

Info

ID:	386095
PubChem CID:	134980768
Reduced:	O3C25H32 (1)
Stoich.:	A3B25C32 (1)
Weight, g/mol:	442.251204
ΔH_f, kcal/mol:	-109.01
Dipole, Da:	2.87
IP(EA), eV:	-8.23(0.71)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

trimethyl-[4-phenyl-3-(2-phenyl-3-trimethylsilylcyclopropyl)-2-tricyclo[3.2.1.02,4]oct-6-enyl]silane

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1)C2C3CCC(C2C4=C(C=C(C=C4OC)C)OC)CC3)OC

DOS

IR

Vibrations