Geometry & MOs

Info

ID:	12887
PubChem CID:	147770
Reduced:	ON6C18H19 (1)
Stoich.:	AB6C18D19 (1)
Weight, g/mol:	335.162034
ΔH_f, kcal/mol:	143.03
Dipole, Da:	3.03
IP(EA), eV:	0.0(0.0)
Spin(S_z, S²):	0.500000, 1.961443
Charge, e:	1

Chem-info

IUPAC name:

N'-(hydroxyamino)-N-[[4-[2-(1-methylimidazo[1,2-a]pyridin-4-ium-2-yl)ethenyl]phenyl]methylideneamino]methanimidamide

Drug info:

PubChemData

Smile

CN1C2=CC=CC=[N+]2C=C1C=CC3=CC=C(C=C3)C=NNC=NNO

DOS

IR

Vibrations