Geometry & MOs

Info

ID:	29949
PubChem CID:	838459
Reduced:	N2O3C13H16 (1)
Stoich.:	A2B3C13D16 (1)
Weight, g/mol:	334.10659
ΔH_f, kcal/mol:	-107.86
Dipole, Da:	4.8
IP(EA), eV:	-9.1(-0.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-methyl-N-[(4-nitrophenyl)methylideneamino]quinoline-3-carboxamide

Drug info:

PubChemData

Smile

CCOC1=CC=C(C=C1)[C@]2(C(=O)N(C(=O)N2)C)C

DOS

IR

Vibrations