Geometry & MOs

Info

ID:	208698
PubChem CID:	80568121
Reduced:	BrClSN2O2H6C10 (1)
Stoich.:	ABCD2E2F6G10 (1)
Weight, g/mol:	292.051778
ΔH_f, kcal/mol:	-23.29
Dipole, Da:	5.12
IP(EA), eV:	-9.2(-1.54)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(2-methoxy-2-oxo-1-phenylethyl)amino]-1,3-thiazole-4-carboxylic acid

Drug info:

PubChemData

Smile

C1=CC(=C(C=C1Br)Cl)NC2=NC(=CS2)C(=O)O

DOS

IR

Vibrations