Geometry & MOs

Info

ID:	255526
PubChem CID:	103132718
Reduced:	NS2O3C12H17 (1)
Stoich.:	AB2C3D12E17 (1)
Weight, g/mol:	273.049336
ΔH_f, kcal/mol:	-120.14
Dipole, Da:	4.93
IP(EA), eV:	-9.04(-1.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[2-[(5-methyloxolan-2-yl)methylsulfanyl]-1,3-thiazol-4-yl]acetic acid

Drug info:

PubChemData

Smile

CC1CCC(O1)CSC2=NC(=C(S2)CC(=O)O)C

DOS

IR

Vibrations