Geometry & MOs

Info

ID:	382089
PubChem CID:	134973017
Reduced:	SiO9C32H46 (1)
Stoich.:	AB9C32D46 (1)
Weight, g/mol:	362.143567
ΔH_f, kcal/mol:	-393.96
Dipole, Da:	8.61
IP(EA), eV:	-8.57(-0.55)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-diphenylphosphoryl-1-(2-tricyclo[4.2.1.02,5]non-7-enyl)ethanone

Drug info:

PubChemData

Smile

CCC[C@H]/1[C@H]([C@@H](C[C@@H](C(=C)C/C(=C1/C(=O)OC)/C(=O)OC)O[Si](C)(C)CC=C)OCC2=CC=C(C=C2)OC)OC(=O)C

DOS

IR

Vibrations