Geometry & MOs

Info

ID:	368754
PubChem CID:	127330005
Reduced:	SO2N4C20H36 (1)
Stoich.:	AB2C4D20E36 (1)
Weight, g/mol:	336.198383
ΔH_f, kcal/mol:	-121.61
Dipole, Da:	2.86
IP(EA), eV:	-8.54(0.84)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(4-methylpyrazol-1-yl)-N-(3-methylsulfanylcyclohexyl)piperidine-1-carboxamide

Drug info:

PubChemData

Smile

CSC1CCCC(C1)NC(=O)N2CCN(CC2)CC(=O)N3CCCCCC3

DOS

IR

Vibrations