Geometry & MOs

Info

ID:	246640
PubChem CID:	103064150
Reduced:	SN2O3C12H18 (1)
Stoich.:	AB2C3D12E18 (1)
Weight, g/mol:	258.103814
ΔH_f, kcal/mol:	-134.85
Dipole, Da:	3.0
IP(EA), eV:	-8.84(0.19)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[1-(thiolan-3-ylcarbamoylamino)cyclobutyl]acetic acid

Drug info:

PubChemData

Smile

C1CC2C(CC1N2C(=O)NC3CCSC3)C(=O)O

DOS

IR

Vibrations