Geometry & MOs

Info

ID:	154361
PubChem CID:	56313778
Reduced:	N2O2C21H30 (1)
Stoich.:	A2B2C21D30 (1)
Weight, g/mol:	446.119769
ΔH_f, kcal/mol:	-112.68
Dipole, Da:	4.19
IP(EA), eV:	-9.24(0.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(2,6-dichlorophenyl)sulfonyl-N-(1,4-dimethylcyclohexyl)piperidine-4-carboxamide

Drug info:

PubChemData

Smile

CC1CCC(CC1)(C)NC(=O)C2CC(=O)N(C2)CC3=CC=C(C=C3)C

DOS

IR

Vibrations