Geometry & MOs

Info

ID:	247917
PubChem CID:	103077479
Reduced:	BrClFSO2N4C11H11 (1)
Stoich.:	ABCDE2F4G11H11 (1)
Weight, g/mol:	401.98158
ΔH_f, kcal/mol:	-67.89
Dipole, Da:	7.96
IP(EA), eV:	-9.33(-1.45)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-amino-4-bromo-5-chloro-N-(2-ethoxyethyl)-N-ethyl-2-fluorobenzenesulfonamide

Drug info:

PubChemData

Smile

CN1C=CN=C1CNS(=O)(=O)C2=CC(=C(C(=C2F)N)Br)Cl

DOS

IR

Vibrations