Geometry & MOs

Info

ID:	12992
PubChem CID:	219741
Reduced:	ON4C7H8 (1)
Stoich.:	AB4C7D8 (1)
Weight, g/mol:	164.069811
ΔH_f, kcal/mol:	24.29
Dipole, Da:	5.25
IP(EA), eV:	-9.78(-0.46)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(4-cyano-2-methylpyrazol-3-yl)acetamide

Drug info:

PubChemData

Smile

CC(=O)NC1=C(C=NN1C)C#N

DOS

IR

Vibrations