Geometry & MOs

Info

ID:	274374
PubChem CID:	103808852
Reduced:	O2N3C16H23 (1)
Stoich.:	A2B3C16D23 (1)
Weight, g/mol:	284.163711
ΔH_f, kcal/mol:	-84.65
Dipole, Da:	1.86
IP(EA), eV:	-8.86(-0.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2R)-N-[4-(pyrazol-1-ylmethyl)phenyl]piperidine-2-carboxamide

Drug info:

PubChemData

Smile

CCNC(=O)CC1=CC=C(C=C1)NC(=O)[C@H]2CCCCN2

DOS

IR

Vibrations