Geometry & MOs

Info

ID:	344094
PubChem CID:	127267270
Reduced:	O3N6C16H22 (1)
Stoich.:	A3B6C16D22 (1)
Weight, g/mol:	295.072369
ΔH_f, kcal/mol:	-67.0
Dipole, Da:	7.14
IP(EA), eV:	-9.43(-0.56)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-chloro-N-(2-methyl-3-nitrophenyl)-3,6-dihydro-2H-pyridine-1-carboxamide

Drug info:

PubChemData

Smile

CCOC(=O)C1=NNC(=N1)C(CC(C)C)NC(=O)NC2=CN=CC=C2

DOS

IR

Vibrations