Geometry & MOs

Info

ID:	295457
PubChem CID:	117529941
Reduced:	ON2C12H20 (1)
Stoich.:	AB2C12D20 (1)
Weight, g/mol:	251.061614
ΔH_f, kcal/mol:	-37.5
Dipole, Da:	2.26
IP(EA), eV:	-9.38(0.3)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[2-(furan-2-yl)-5-methyl-1,3-thiazol-4-yl]-2-methylpropanoic acid

Drug info:

PubChemData

Smile

CC(C)(CN)C1=COC(=N1)C2CCCC2

DOS

IR

Vibrations