Geometry & MOs

Info

ID:	247940
PubChem CID:	103077651
Reduced:	BrClFSO2N4C11H11 (1)
Stoich.:	ABCDE2F4G11H11 (1)
Weight, g/mol:	381.93022
ΔH_f, kcal/mol:	-71.97
Dipole, Da:	7.4
IP(EA), eV:	-9.15(-1.27)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-amino-4-bromo-5-chloro-2-fluoro-N-(4-methyl-1H-pyrazol-5-yl)benzenesulfonamide

Drug info:

PubChemData

Smile

CC1=C(NN=C1NS(=O)(=O)C2=CC(=C(C(=C2F)N)Br)Cl)C

DOS

IR

Vibrations