Geometry & MOs

Info

ID:	350326
PubChem CID:	127277404
Reduced:	N3O3C22H29 (1)
Stoich.:	A3B3C22D29 (1)
Weight, g/mol:	394.192629
ΔH_f, kcal/mol:	-133.68
Dipole, Da:	5.14
IP(EA), eV:	-9.29(-1.03)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(benzenesulfonyl)-N-(2-cyclohexyl-2-hydroxyethyl)piperidine-2-carboxamide

Drug info:

PubChemData

Smile

C1CCC(CC1)C(CNC(=O)C2=CC3=C(C=C2)C(=O)N4CCCCCC4=N3)O

DOS

IR

Vibrations