Geometry & MOs

Info

ID:	208790
PubChem CID:	80586479
Reduced:	SN2O4C12H16 (1)
Stoich.:	AB2C4D12E16 (1)
Weight, g/mol:	272.119464
ΔH_f, kcal/mol:	-145.25
Dipole, Da:	7.57
IP(EA), eV:	-9.02(-0.93)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(thiolan-2-ylmethylcarbamoylamino)cyclopentane-1-carboxylic acid

Drug info:

PubChemData

Smile

C1CC(SC1)CNC(=O)NCC2=CC=C(O2)C(=O)O

DOS

IR

Vibrations