Geometry & MOs

Info

ID:

52519

PubChem CID:

12015406

Reduced:

O2H12C13 (3)

Stoich.:

A2B12C13 (3)

Weight, g/mol:

708.469502

ΔHf, kcal/mol:

-127.04

Dipole, Da:

7.66

IP(EA), eV:

 -9.89(-0.9)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

2-[3,5-bis(3,3-dimethyl-4-phenyl-2-tricyclo[3.3.0.02,4]octanyl)phenyl]-3,3-dimethyl-4-phenyltricyclo[3.3.0.02,4]octane

Drug info:

PubChemData

Smile

CC(C)(C(=O)C1=CC=CC=C1)C(=O)C2=CC(=CC(=C2)C(=O)C(C)(C)C(=O)C3=CC=CC=C3)C(=O)C(C)(C)C(=O)C4=CC=CC=C4

DOS

IR

Vibrations