Geometry & MOs

Info

ID:	247937
PubChem CID:	103077641
Reduced:	BrClFSN2O3C9H9 (1)
Stoich.:	ABCDE2F3G9H9 (1)
Weight, g/mol:	400.96118
ΔH_f, kcal/mol:	-111.05
Dipole, Da:	3.68
IP(EA), eV:	-9.24(-1.29)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[(3-amino-4-bromo-5-chloro-2-fluorophenyl)sulfonylamino]-N-ethylpropanamide

Drug info:

PubChemData

Smile

C1CN(OC1)S(=O)(=O)C2=CC(=C(C(=C2F)N)Br)Cl

DOS

IR

Vibrations