Geometry & MOs

Info

ID:	271402
PubChem CID:	103674948
Reduced:	ClSN4C11H17 (1)
Stoich.:	ABC4D11E17 (1)
Weight, g/mol:	442.9047
ΔH_f, kcal/mol:	6.58
Dipole, Da:	4.26
IP(EA), eV:	-8.74(-0.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,5-dibromo-N-(3-methylsulfanylcyclohexyl)benzenesulfonamide

Drug info:

PubChemData

Smile

CSC1CCCC(C1)NC2=CC(=NC(=N2)N)Cl

DOS

IR

Vibrations