Geometry & MOs

Info

ID:	173978
PubChem CID:	75707699
Reduced:	N2O3C25H40 (1)
Stoich.:	A2B3C25D40 (1)
Weight, g/mol:	528.265794
ΔH_f, kcal/mol:	-174.78
Dipole, Da:	6.56
IP(EA), eV:	-9.08(-0.29)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-hexyl-N-[1-(3-hydroxyphenyl)-2-[(4-methylphenyl)sulfonylmethylamino]-2-oxoethyl]cyclohexanecarboxamide

Drug info:

PubChemData

Smile

CCCCCCN(C(C1=CC(=CC=C1)O)C(=O)NC(C)(C)C)C(=O)C2CCCCC2

DOS

IR

Vibrations