Geometry & MOs

Info

ID:	51632
PubChem CID:	12014335
Reduced:	NPO3H24C35 (1)
Stoich.:	ABC3D24E35 (1)
Weight, g/mol:	517.159551
ΔH_f, kcal/mol:	67.13
Dipole, Da:	6.76
IP(EA), eV:	-8.95(-1.43)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(10-diphenylphosphoryl-11H-benzo[b]fluoren-5-yl)benzonitrile

Drug info:

PubChemData

Smile

C1C2=CC=CC=C2C3=C(C4=CC=CC=C4C(=C31)P(=O)(C5=CC=CC=C5)C6=CC=CC=C6)C7=CC=C(C=C7)[N+](=O)[O-]

DOS

IR

Vibrations