Geometry & MOs

Info

ID:	228522
PubChem CID:	87565191
Reduced:	INO4C10H18 (1)
Stoich.:	ABC4D10E18 (1)
Weight, g/mol:	353.076018
ΔH_f, kcal/mol:	-177.66
Dipole, Da:	6.14
IP(EA), eV:	-10.25(-1.95)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(5E)-5-[(2-methyl-3,5-dinitrophenyl)hydrazinylidene]quinolin-8-one

Drug info:

PubChemData

Smile

CCC[C@](C(=O)OCC)(NC(C)C(=O)O)I

DOS

IR

Vibrations