Geometry & MOs

Info

ID:	277321
PubChem CID:	103827828
Reduced:	ON3C12H19 (1)
Stoich.:	AB3C12D19 (1)
Weight, g/mol:	236.163711
ΔH_f, kcal/mol:	-27.13
Dipole, Da:	4.43
IP(EA), eV:	-9.58(-0.23)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S)-N-(1-pyrazol-1-ylpropan-2-yl)piperidine-2-carboxamide

Drug info:

PubChemData

Smile

CCC[C@H](C(=O)N(C)CC1=CC=NC=C1)N

DOS

IR

Vibrations