Geometry & MOs

Info

ID:	226160
PubChem CID:	87325991
Reduced:	NO4C10H21 (1)
Stoich.:	AB4C10D21 (1)
Weight, g/mol:	213.045964
ΔH_f, kcal/mol:	-220.99
Dipole, Da:	3.68
IP(EA), eV:	-10.21(0.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(2-methyl-1,3-thiazol-4-yl)methyl]-4-oxobutanoic acid

Drug info:

PubChemData

Smile

C.CC(C)(C)C(C[C@@H](C(=O)O)N)C(=O)O

DOS

IR

Vibrations