Geometry & MOs

Info

ID:	446034
PubChem CID:	135271805
Reduced:	NH16C25 (2)
Stoich.:	AB16C25 (2)
Weight, g/mol:	586.240899
ΔH_f, kcal/mol:	219.95
Dipole, Da:	2.16
IP(EA), eV:	-7.96(-0.75)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(4-carbazol-9-ylphenyl)-N-(4-phenylphenyl)phenanthren-4-amine

Drug info:

PubChemData

Smile

C1=CC=C2C(=C1)C=CC3=C2C(=CC=C3)N(C4=CC=C(C=C4)N5C6=CC=CC=C6C7=CC=CC=C75)C8=CC9=C(C=C8)C1=CC=CC=C1C1=CC=CC=C19

DOS

IR

Vibrations