Geometry & MOs

Info

ID:	208205
PubChem CID:	80503616
Reduced:	NO3C13H13 (1)
Stoich.:	AB3C13D13 (1)
Weight, g/mol:	263.061614
ΔH_f, kcal/mol:	-55.31
Dipole, Da:	6.54
IP(EA), eV:	-9.96(-1.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(4-ethoxyphenyl)-5-methyl-1,3-thiazole-4-carboxylic acid

Drug info:

PubChemData

Smile

CCCC1=CC=C(C=C1)C2=C(C=NO2)C(=O)O

DOS

IR

Vibrations