Geometry & MOs

Info

ID:	213935
PubChem CID:	81065568
Reduced:	NSO6C10H19 (1)
Stoich.:	ABC6D10E19 (1)
Weight, g/mol:	349.99359
ΔH_f, kcal/mol:	-281.23
Dipole, Da:	3.47
IP(EA), eV:	-10.38(0.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[[(5-bromopyridin-3-yl)sulfonylamino]methyl]pentanoic acid

Drug info:

PubChemData

Smile

CC(CC(=O)O)CNS(=O)(=O)CCCC(=O)OC

DOS

IR

Vibrations