Geometry & MOs

Info

ID:	250654
PubChem CID:	103098119
Reduced:	BrSN2O2F3H6C11 (1)
Stoich.:	ABC2D2E3F6G11 (1)
Weight, g/mol:	294.048584
ΔH_f, kcal/mol:	-146.52
Dipole, Da:	4.82
IP(EA), eV:	-9.29(-1.47)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 4-[(2,6-difluoropyridin-3-yl)sulfamoyl]butanoate

Drug info:

PubChemData

Smile

C1=CC(=C(C=C1F)Br)S(=O)(=O)NC2=C(N=C(C=C2)F)F

DOS

IR

Vibrations