Geometry & MOs

Info

ID:	344199
PubChem CID:	127267375
Reduced:	ON6C14H22 (1)
Stoich.:	AB6C14D22 (1)
Weight, g/mol:	325.0187
ΔH_f, kcal/mol:	37.21
Dipole, Da:	4.41
IP(EA), eV:	-8.63(-1.71)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-chloro-2-fluoro-5-[1-hydroxypropan-2-yl(methyl)sulfamoyl]benzoic acid

Drug info:

PubChemData

Smile

CC(C)(CCCN(C)C)NC(=O)C1=CC=CN2C1=NN=N2

DOS

IR

Vibrations