Geometry & MOs

Info

ID:	354722
PubChem CID:	127287421
Reduced:	O2N6C17H26 (1)
Stoich.:	A2B6C17D26 (1)
Weight, g/mol:	267.194677
ΔH_f, kcal/mol:	-49.34
Dipole, Da:	8.34
IP(EA), eV:	-8.96(-0.52)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(1-acetylpiperidin-4-yl)methyl]-3-methylpyrrolidine-1-carboxamide

Drug info:

PubChemData

Smile

CC(=O)N1CCC(CC1)CNC(=O)N2CCN(CC2)C3=NN=CC=C3

DOS

IR

Vibrations