Geometry & MOs

Info

ID:	347259
PubChem CID:	127271800
Reduced:	O2N3S3C17H25 (1)
Stoich.:	A2B3C3D17E25 (1)
Weight, g/mol:	304.189926
ΔH_f, kcal/mol:	-68.61
Dipole, Da:	3.28
IP(EA), eV:	-8.55(-0.29)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-cyclohexyl-1-methyl-N-(2-oxopiperidin-3-yl)pyrazole-4-carboxamide

Drug info:

PubChemData

Smile

CC(C)(C)C1=NC(=CS1)CC(=O)N2CSCC2C(=O)N3CCSCC3

DOS

IR

Vibrations