Geometry & MOs

Info

ID:	60651
PubChem CID:	26697343
Reduced:	BrNO3C15H20 (1)
Stoich.:	ABC3D15E20 (1)
Weight, g/mol:	394.192629
ΔH_f, kcal/mol:	-112.81
Dipole, Da:	3.83
IP(EA), eV:	-8.77(-0.44)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-cyclopentyl-4-methoxy-3-[[(1R,2S)-2-methylcyclohexyl]sulfamoyl]benzamide

Drug info:

PubChemData

Smile

CCOC1=C(C(=CC(=C1)C(=O)NC2CCCC2)Br)OC

DOS

IR

Vibrations