Geometry & MOs

Info

ID:	291669
PubChem CID:	113457752
Reduced:	NC16H33 (1)
Stoich.:	AB16C33 (1)
Weight, g/mol:	270.067428
ΔH_f, kcal/mol:	-67.72
Dipole, Da:	1.43
IP(EA), eV:	-8.62(3.15)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-hydroxy-3-(2-methylsulfanylethylcarbamoylamino)benzoic acid

Drug info:

PubChemData

Smile

CCCC1CCCC(CC1)NC(C)C(C)(C)C

DOS

IR

Vibrations