Geometry & MOs

Info

ID:	338615
PubChem CID:	127259626
Reduced:	ON3C13H13 (1)
Stoich.:	AB3C13D13 (1)
Weight, g/mol:	310.002431
ΔH_f, kcal/mol:	84.44
Dipole, Da:	1.74
IP(EA), eV:	-8.73(-0.42)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(E)-benzylideneamino]-3,4-dichloro-5-nitropyridin-2-amine

Drug info:

PubChemData

Smile

CON(C1=CC=CC=N1)/N=C/C2=CC=CC=C2

DOS

IR

Vibrations