Geometry & MOs

Info

ID:	316583
PubChem CID:	126631271
Reduced:	N2H32C45 (1)
Stoich.:	A2B32C45 (1)
Weight, g/mol:	550.240899
ΔH_f, kcal/mol:	194.94
Dipole, Da:	1.08
IP(EA), eV:	-7.78(-0.53)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CN1C2=CC=CC(=C2C3=C1C4=CC=CC=C4C5=CC=CC=C53)C6=CC=C(C=C6)N(C7=CC=CC=C7)C8=CC=C(C=C8)C9=CC=CC=C9

DOS

IR

Vibrations