Geometry & MOs

Info

ID:	288138
PubChem CID:	104311853
Reduced:	BrNOF2H6C12 (1)
Stoich.:	ABCD2E6F12 (1)
Weight, g/mol:	361.85471
ΔH_f, kcal/mol:	-57.77
Dipole, Da:	4.24
IP(EA), eV:	-10.07(-1.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(3,5-dibromopyridin-2-yl)-2-(1,3-thiazol-2-yl)ethanone

Drug info:

PubChemData

Smile

C1=CC(=C(C(=C1)F)C(=O)C2=C(C=CC=N2)Br)F

DOS

IR

Vibrations