Geometry & MOs

Info

ID:	328814
PubChem CID:	126728103
Reduced:	NSC17H27 (1)
Stoich.:	ABC17D27 (1)
Weight, g/mol:	818.340947
ΔH_f, kcal/mol:	-31.08
Dipole, Da:	3.31
IP(EA), eV:	-8.64(0.05)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[1-[3-[9-phenyl-6-(9-phenylcarbazol-3-yl)carbazol-3-yl]phenyl]ethylidene]-N'-(1-phenylpropa-1,2-dienyl)benzenecarboximidamide

Drug info:

PubChemData

Smile

CCCCCCC1CCSC1C2=CC(=NC(=C2)C)C

DOS

IR

Vibrations