Geometry & MOs

Info

ID:	54464
PubChem CID:	17388719
Reduced:	SO3N4C18H22 (1)
Stoich.:	AB3C4D18E22 (1)
Weight, g/mol:	495.9189
ΔH_f, kcal/mol:	-42.34
Dipole, Da:	11.69
IP(EA), eV:	-8.99(-1.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(Z)-[(Z)-1,3-di(selenophen-2-yl)prop-2-enylidene]amino]-2,4-dinitroaniline

Drug info:

PubChemData

Smile

CCCCCOC1=CC=C(C=C1)/C=N/NC(=O)C2=CC(=O)N=C(N2)SC

DOS

IR

Vibrations