Geometry & MOs

Info

ID:	208673
PubChem CID:	80564618
Reduced:	N2O4H12C15 (1)
Stoich.:	A2B4C12D15 (1)
Weight, g/mol:	239.08254
ΔH_f, kcal/mol:	-116.88
Dipole, Da:	7.44
IP(EA), eV:	-8.96(-1.35)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-chloro-N-(pyrrolidin-3-ylmethyl)pyridine-4-carboxamide

Drug info:

PubChemData

Smile

C1C(C2=CC=CC=C2N1C(=O)C3=CC=CNC3=O)C(=O)O

DOS

IR

Vibrations