Geometry & MOs

Info

ID:	371239
PubChem CID:	127344459
Reduced:	ON4C17H28 (1)
Stoich.:	AB4C17D28 (1)
Weight, g/mol:	290.210661
ΔH_f, kcal/mol:	-42.14
Dipole, Da:	2.23
IP(EA), eV:	-9.15(0.75)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(4-methylcyclohexyl)-4-(1H-pyrazol-5-yl)piperidine-1-carboxamide

Drug info:

PubChemData

Smile

CC1CCC(CC1)NC(=O)N2CCC(CC2)C3=CN(N=C3)C

DOS

IR

Vibrations