Geometry & MOs

Info

ID:	153708
PubChem CID:	56313008
Reduced:	FON4C24H27 (1)
Stoich.:	ABC4D24E27 (1)
Weight, g/mol:	420.208279
ΔH_f, kcal/mol:	-3.76
Dipole, Da:	4.24
IP(EA), eV:	-8.88(-0.49)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(3-acetylphenyl)sulfonyl-N-(1,4-dimethylcyclohexyl)piperidine-4-carboxamide

Drug info:

PubChemData

Smile

C1CN(CCN(C1)C(=O)CCC2=CN(N=C2)C3=CC=CC=C3)CC4=CC=CC=C4F

DOS

IR

Vibrations