Geometry & MOs

Info

ID:	151611
PubChem CID:	55161665
Reduced:	OSN3C13H21 (1)
Stoich.:	ABC3D13E21 (1)
Weight, g/mol:	267.11384
ΔH_f, kcal/mol:	-28.92
Dipole, Da:	3.08
IP(EA), eV:	-8.4(-0.42)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-chloro-N-methyl-N-(2-pyrrolidin-1-ylethyl)pyridine-3-carboxamide

Drug info:

PubChemData

Smile

CC1=C(C=C(S1)C(=O)N(C)CCN2CCCC2)N

DOS

IR

Vibrations