Geometry & MOs

Info

ID:	380675
PubChem CID:	134971195
Reduced:	PO2H21C29 (1)
Stoich.:	AB2C21D29 (1)
Weight, g/mol:	416.133002
ΔH_f, kcal/mol:	25.37
Dipole, Da:	4.85
IP(EA), eV:	-8.86(-0.19)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(8,11-diphenyl-1-phosphatricyclo[6.2.2.02,7]dodeca-2,4,6,9,11-pentaen-10-yl)phenol

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)C2=CC3(C=C(P2(=O)C4=CC=CC=C43)C5=CC=CC=C5O)C6=CC=CC=C6

DOS

IR

Vibrations