Geometry & MOs

Info

ID:	33589
PubChem CID:	7887094
Reduced:	SN2O5C21H22 (1)
Stoich.:	AB2C5D21E22 (1)
Weight, g/mol:	335.082744
ΔH_f, kcal/mol:	-140.24
Dipole, Da:	9.55
IP(EA), eV:	-8.76(-0.73)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2-(2,5-dimethoxyphenyl)-2-oxoethyl] 2,4-dimethyl-1,3-thiazole-5-carboxylate

Drug info:

PubChemData

Smile

COC1=CC(=C(C=C1)OC)C(=O)CSC2=NC3=CC=CC=C3C(=O)N2CCCO

DOS

IR

Vibrations