Geometry & MOs

Info

ID:	396817
PubChem CID:	135029273
Reduced:	PH13C18 (1)
Stoich.:	AB13C18 (1)
Weight, g/mol:	276.070402
ΔH_f, kcal/mol:	73.16
Dipole, Da:	1.48
IP(EA), eV:	-8.25(-0.73)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-phenyl-2lambda5-phosphatricyclo[7.3.1.05,13]trideca-1(12),3,5,7,9(13),10-hexaene 2-oxide

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)P2C=CC3=CC=CC4=C3C2=CC=C4

DOS

IR

Vibrations