Geometry & MOs

Info

ID:	246637
PubChem CID:	103064113
Reduced:	SN2O3C10H16 (1)
Stoich.:	AB2C3D10E16 (1)
Weight, g/mol:	260.119464
ΔH_f, kcal/mol:	-136.38
Dipole, Da:	7.25
IP(EA), eV:	-8.89(0.0)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-(thiolan-3-ylcarbamoylamino)hexanoic acid

Drug info:

PubChemData

Smile

C1CC(C1)(C(=O)O)NC(=O)NC2CCSC2

DOS

IR

Vibrations