Geometry & MOs

Info

ID:	174128
PubChem CID:	75728194
Reduced:	N2O5C26H42 (1)
Stoich.:	A2B5C26D42 (1)
Weight, g/mol:	470.223929
ΔH_f, kcal/mol:	-277.87
Dipole, Da:	5.56
IP(EA), eV:	-9.2(-0.03)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-[(4-methylphenyl)sulfonylmethylamino]-2-oxo-1-phenylethyl]-N-propylcyclohexanecarboxamide

Drug info:

PubChemData

Smile

CCCN(C(C1=C(C=C(C=C1O)O)O)C(=O)NC(C)(C)CC(C)(C)C)C(=O)C2CCCCC2

DOS

IR

Vibrations