Geometry & MOs

Info

ID:	204662
PubChem CID:	79994740
Reduced:	BrNO2S2C12H20 (1)
Stoich.:	ABC2D2E12F20 (1)
Weight, g/mol:	378.937
ΔH_f, kcal/mol:	-80.87
Dipole, Da:	4.68
IP(EA), eV:	-9.37(-1.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-bromo-4-methyl-N-(1-thiophen-2-ylpropyl)thiophene-2-sulfonamide

Drug info:

PubChemData

Smile

CC1=C(SC(=C1)S(=O)(=O)NC(C)CCC(C)C)Br

DOS

IR

Vibrations