Geometry & MOs

Info

ID:	284852
PubChem CID:	104077405
Reduced:	SN2O2C11H16 (1)
Stoich.:	AB2C2D11E16 (1)
Weight, g/mol:	225.98707
ΔH_f, kcal/mol:	-39.03
Dipole, Da:	2.23
IP(EA), eV:	-9.49(-0.65)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 2-(1,3-thiazol-2-yl)-1,3-thiazole-4-carboxylate

Drug info:

PubChemData

Smile

CCOC(=O)C(C1=NC=CS1)NCC2CC2

DOS

IR

Vibrations