Geometry & MOs

Info

ID:	316232
PubChem CID:	126630425
Reduced:	O5N6C29H40 (1)
Stoich.:	A5B6C29D40 (1)
Weight, g/mol:	763.298748
ΔH_f, kcal/mol:	-180.29
Dipole, Da:	3.2
IP(EA), eV:	-9.39(-0.96)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

8-[9-methyl-6-(7-phenylbenzo[c]carbazol-10-yl)carbazol-4-yl]-11-phenylbenzo[a]carbazole

Drug info:

PubChemData

Smile

CCC1=NC=C2C=CC(=CC2=N1)/C=C/C(C)(C)C(=O)NC(C(C)C)C(=O)NC(C)C(=O)N3CCCC(N3)C(=O)O

DOS

IR

Vibrations