Geometry & MOs

Info

ID:	288110
PubChem CID:	104311469
Reduced:	BrFNOH9C13 (1)
Stoich.:	ABCDE9F13 (1)
Weight, g/mol:	320.95715
ΔH_f, kcal/mol:	-24.07
Dipole, Da:	1.57
IP(EA), eV:	-9.9(-1.32)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(5-bromopyridin-2-yl)-2-imidazo[2,1-b][1,3]thiazol-6-ylethanone

Drug info:

PubChemData

Smile

CC1=C(C=CC(=C1)F)C(=O)C2=NC=C(C=C2)Br

DOS

IR

Vibrations