Geometry & MOs

Info

ID:	154029
PubChem CID:	56313391
Reduced:	F2O3N4C24H26 (1)
Stoich.:	A2B3C4D24E26 (1)
Weight, g/mol:	396.188292
ΔH_f, kcal/mol:	-168.97
Dipole, Da:	2.94
IP(EA), eV:	-8.98(-0.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(1,4-dimethylcyclohexyl)-1-(4-fluorophenyl)sulfonylpiperidine-4-carboxamide

Drug info:

PubChemData

Smile

CC1(C(=O)N(C(=O)N1)CC(=O)N2CCCN(CC2)CC3=CC=CC=C3F)C4=CC=C(C=C4)F

DOS

IR

Vibrations