Geometry & MOs

Info

ID:	247960
PubChem CID:	103077765
Reduced:	BrClFSN2O2C13H17 (1)
Stoich.:	ABCDE2F2G13H17 (1)
Weight, g/mol:	401.98158
ΔH_f, kcal/mol:	-129.4
Dipole, Da:	3.66
IP(EA), eV:	-9.18(-1.15)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-amino-4-bromo-5-chloro-N-(2-ethoxy-2-methylpropyl)-2-fluorobenzenesulfonamide

Drug info:

PubChemData

Smile

C[C@@H]1CCC[C@@H](N1S(=O)(=O)C2=CC(=C(C(=C2F)N)Br)Cl)C

DOS

IR

Vibrations