Geometry & MOs

Info

ID:	181910
PubChem CID:	76812820
Reduced:	O3N5C24H31 (1)
Stoich.:	A3B5C24D31 (1)
Weight, g/mol:	283.132077
ΔH_f, kcal/mol:	0.43
Dipole, Da:	3.88
IP(EA), eV:	-8.68(-1.64)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-methyl-N-oxo-7-piperidin-4-ylidene-4aH-quinoline-3-carboxamide

Drug info:

PubChemData

Smile

CCN1CCC(CC1)(C)C(=O)NC2CC(=C3C=CC4C=C(C=NC4=C3)C(=O)N=O)CCN2

DOS

IR

Vibrations