Geometry & MOs

Info

ID:	274750
PubChem CID:	103811489
Reduced:	ON4C8H14 (1)
Stoich.:	AB4C8D14 (1)
Weight, g/mol:	222.148061
ΔH_f, kcal/mol:	-9.1
Dipole, Da:	1.46
IP(EA), eV:	-8.54(0.52)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S)-N-(1,3-dimethylpyrazol-4-yl)piperidine-2-carboxamide

Drug info:

PubChemData

Smile

CC1=NN(C=C1NC(=O)CNC)C

DOS

IR

Vibrations