Geometry & MOs

Info

ID:	316616
PubChem CID:	126631323
Reduced:	N2H32C45 (1)
Stoich.:	A2B32C45 (1)
Weight, g/mol:	474.209599
ΔH_f, kcal/mol:	187.5
Dipole, Da:	2.44
IP(EA), eV:	-7.97(-0.71)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-methyl-N-phenyl-5-(3-phenylphenyl)benzo[b]carbazol-2-amine

Drug info:

PubChemData

Smile

CN1C2=C(C=CC(=C2)C3=CC=C(C=C3)N(C4=CC=CC=C4)C5=CC=CC(=C5)C6=CC=CC=C6)C7=C1C8=CC=CC=C8C9=CC=CC=C97

DOS

IR

Vibrations