Geometry & MOs

Info

ID:	300223
PubChem CID:	121269878
Reduced:	NF3O5H8C10 (1)
Stoich.:	AB3C5D8E10 (1)
Weight, g/mol:	263.92559
ΔH_f, kcal/mol:	-307.6
Dipole, Da:	4.55
IP(EA), eV:	-10.28(-1.57)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-bromo-5-fluoro-2,3-dihydro-1-benzothiophene 1,1-dioxide

Drug info:

PubChemData

Smile

COC(=O)N(C1=CC=C(C=C1)C(=O)O)OC(F)(F)F

DOS

IR

Vibrations