Geometry & MOs

Info

ID:	316545
PubChem CID:	126631201
Reduced:	N2H30C41 (1)
Stoich.:	A2B30C41 (1)
Weight, g/mol:	550.240899
ΔH_f, kcal/mol:	172.85
Dipole, Da:	1.23
IP(EA), eV:	-7.82(-0.68)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-methyl-N-phenyl-4-[5-(4-phenylphenyl)benzo[b]carbazol-2-yl]aniline

Drug info:

PubChemData

Smile

CN1C2=C(C=C(C=C2)C3=CC=C(C=C3)N(C4=CC=CC=C4)C5=CC=C(C=C5)C6=CC=CC=C6)C7=CC8=CC=CC=C8C=C71

DOS

IR

Vibrations