Geometry & MOs

Info

ID:	251006
PubChem CID:	103100788
Reduced:	BrClNO2S2C9H13 (1)
Stoich.:	ABCD2E2F9G13 (1)
Weight, g/mol:	384.95726
ΔH_f, kcal/mol:	-71.24
Dipole, Da:	4.4
IP(EA), eV:	-9.53(-1.25)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-bromocycloheptyl)-5-chloro-4-methylthiophene-2-sulfonamide

Drug info:

PubChemData

Smile

CC1=C(SC(=C1)S(=O)(=O)NCCC(C)Br)Cl

DOS

IR

Vibrations