Geometry & MOs

Info

ID:	128482
PubChem CID:	51046153
Reduced:	FOCl2N2H11C14 (1)
Stoich.:	ABC2D2E11F14 (1)
Weight, g/mol:	299.95681
ΔH_f, kcal/mol:	-66.55
Dipole, Da:	4.89
IP(EA), eV:	-8.98(-0.63)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(2-amino-1,3-thiazol-4-yl)-2-bromo-6-methoxyphenol

Drug info:

PubChemData

Smile

CC1=C(C=C(C=C1)NC(=O)NC2=C(C=CC(=C2)Cl)F)Cl

DOS

IR

Vibrations