Geometry & MOs

Info

ID:	372489
PubChem CID:	131298534
Reduced:	BrNSO2H8C10 (1)
Stoich.:	ABCD2E8F10 (1)
Weight, g/mol:	256.007326
ΔH_f, kcal/mol:	-34.01
Dipole, Da:	3.62
IP(EA), eV:	-9.48(-1.5)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-amino-2-(3-chloro-4-methoxyphenyl)-1,3-thiazol-4-one

Drug info:

PubChemData

Smile

CCOC(=O)C1=CC2=C(C=C1Br)N=CS2

DOS

IR

Vibrations