Geometry & MOs

Info

ID:	174799
PubChem CID:	75817021
Reduced:	N2O3C22H24 (1)
Stoich.:	A2B3C22D24 (1)
Weight, g/mol:	357.088019
ΔH_f, kcal/mol:	-61.32
Dipole, Da:	4.25
IP(EA), eV:	-8.71(0.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(4-chlorobenzoyl)-N-(4-oxopyridin-3-ylidene)piperidine-3-carboxamide

Drug info:

PubChemData

Smile

CC1=CC=CC=C1C(C)NC(=O)NC2=CC=CC(=C2)COCC3=CC=CO3

DOS

IR

Vibrations