Geometry & MOs

Info

ID:	370692
PubChem CID:	127339881
Reduced:	OSN4C22H30 (1)
Stoich.:	ABC4D22E30 (1)
Weight, g/mol:	275.199762
ΔH_f, kcal/mol:	-1.27
Dipole, Da:	4.06
IP(EA), eV:	-8.73(-0.58)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

cyclohexyl-[4-(2-methylpyrazol-3-yl)piperidin-1-yl]methanone

Drug info:

PubChemData

Smile

CN1C(=CC=N1)C2CCN(CC2)C(=O)C3=C(N=CC=C3)SCC4CCCCC4

DOS

IR

Vibrations