Geometry & MOs

Info

ID:	386758
PubChem CID:	134982818
Reduced:	NO2H19C32 (1)
Stoich.:	AB2C19D32 (1)
Weight, g/mol:	738.03808
ΔH_f, kcal/mol:	57.93
Dipole, Da:	4.79
IP(EA), eV:	-9.04(-1.54)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

9,12-bis(4-bromophenyl)-10-phenanthren-4-ylbenzo[e]pyrene

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)C2=C3C(=C(C4=C2C5=CC=CC=C5C6=CC=CC=C64)C7=CC=CC=C7)C(=O)NC3=O

DOS

IR

Vibrations