Geometry & MOs

Info

ID:	347143
PubChem CID:	127271647
Reduced:	ON7C19H23 (1)
Stoich.:	AB7C19D23 (1)
Weight, g/mol:	318.205576
ΔH_f, kcal/mol:	77.38
Dipole, Da:	5.96
IP(EA), eV:	-9.16(-0.76)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-cyclohexyl-1-methyl-N-(2-oxo-2-pyrrolidin-1-ylethyl)pyrazole-4-carboxamide

Drug info:

PubChemData

Smile

CN1C=C(C(=N1)C2CCCCC2)C(=O)NC3=CC=CC(=C3)C4=NN=NN4C

DOS

IR

Vibrations