Geometry & MOs

Info

ID:	69897
PubChem CID:	47205715
Reduced:	N2O3C12H18 (1)
Stoich.:	A2B3C12D18 (1)
Weight, g/mol:	269.093104
ΔH_f, kcal/mol:	-123.35
Dipole, Da:	3.68
IP(EA), eV:	-9.47(-0.09)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-amino-2-oxoethyl)-N-butyl-2-chloropyridine-4-carboxamide

Drug info:

PubChemData

Smile

CCCCN(CC(=O)N)C(=O)C1=C(OC=C1)C

DOS

IR

Vibrations