Geometry & MOs

Info

ID:	338616
PubChem CID:	127259627
Reduced:	ClON2H4C6 (2)
Stoich.:	ABC2D4E6 (2)
Weight, g/mol:	302.101505
ΔH_f, kcal/mol:	80.8
Dipole, Da:	7.74
IP(EA), eV:	-9.21(-1.86)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)/C=N/NC2=NC=C(C(=C2Cl)Cl)[N+](=O)[O-]

DOS

IR

Vibrations