Geometry & MOs

Info

ID:	285858
PubChem CID:	104134026
Reduced:	ClO2N3C14H20 (1)
Stoich.:	AB2C3D14E20 (1)
Weight, g/mol:	311.140055
ΔH_f, kcal/mol:	-84.5
Dipole, Da:	2.53
IP(EA), eV:	-9.77(-0.88)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-chloro-N-methyl-N-[2-oxo-2-(propylamino)ethyl]-6-propylpyridine-4-carboxamide

Drug info:

PubChemData

Smile

CCCNC(=O)CN(C)C(=O)C1=CC(=NC(=C1)Cl)CC

DOS

IR

Vibrations