Geometry & MOs

Info

ID:	371240
PubChem CID:	127344460
Reduced:	ON4C16H26 (1)
Stoich.:	AB4C16D26 (1)
Weight, g/mol:	304.226312
ΔH_f, kcal/mol:	-41.98
Dipole, Da:	3.89
IP(EA), eV:	-9.43(0.66)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(4-methylcyclohexyl)-4-(2-methylpyrazol-3-yl)piperidine-1-carboxamide

Drug info:

PubChemData

Smile

CC1CCC(CC1)NC(=O)N2CCC(CC2)C3=CC=NN3

DOS

IR

Vibrations