Geometry & MOs

Info

ID:	60684
PubChem CID:	26697411
Reduced:	SN2O4C17H26 (1)
Stoich.:	AB2C4D17E26 (1)
Weight, g/mol:	402.06128
ΔH_f, kcal/mol:	-176.89
Dipole, Da:	4.98
IP(EA), eV:	-9.6(-0.63)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-bromo-5-(tert-butylsulfamoyl)-N-cyclopentylbenzamide

Drug info:

PubChemData

Smile

CC(C)(C)NS(=O)(=O)C1=C(C=CC(=C1)C(=O)NC2CCCC2)OC

DOS

IR

Vibrations