Geometry & MOs

Info

ID:	229817
PubChem CID:	87569191
Reduced:	NO2C16H17 (1)
Stoich.:	AB2C16D17 (1)
Weight, g/mol:	223.89543
ΔH_f, kcal/mol:	-9.87
Dipole, Da:	6.45
IP(EA), eV:	-8.41(-0.89)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-bromo-2,2-difluoroethanesulfonic acid

Drug info:

PubChemData

Smile

CCN(CC)C1=CC2=C(C=C1)C(=C(C(=O)O2)C)C#C

DOS

IR

Vibrations