Geometry & MOs

Info

ID:	298408
PubChem CID:	117649335
Reduced:	N3H35C50 (1)
Stoich.:	A3B35C50 (1)
Weight, g/mol:	709.272927
ΔH_f, kcal/mol:	204.78
Dipole, Da:	1.9
IP(EA), eV:	-7.7(-0.59)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-methoxy-6-(6-methoxy-9-phenylcarbazol-3-yl)-9-(9-phenylcarbazol-2-yl)carbazole

Drug info:

PubChemData

Smile

CC1=CC2=C(C=C1)N(C3=C2C=C(C=C3)C4=CC5=C(C=C4)N(C6=C5C=C(C=C6)C)C7=CC8=C(C=C7)N(C9=CC=CC=C98)C1=CC=CC=C1)C1=CC=CC=C1

DOS

IR

Vibrations