Geometry & MOs

Info

ID:	238110
PubChem CID:	92729694
Reduced:	SN3O4C21H31 (1)
Stoich.:	AB3C4D21E31 (1)
Weight, g/mol:	421.203528
ΔH_f, kcal/mol:	-183.88
Dipole, Da:	4.26
IP(EA), eV:	-9.24(-0.44)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3S)-N-(cyclohexylmethyl)-1-[3-(methanesulfonamido)benzoyl]piperidine-3-carboxamide

Drug info:

PubChemData

Smile

CS(=O)(=O)NC1=CC=CC(=C1)C(=O)N2CCC[C@H](C2)C(=O)NCC3CCCCC3

DOS

IR

Vibrations