Geometry & MOs

Info

ID:	288896
PubChem CID:	104327921
Reduced:	BrFOH14C16 (1)
Stoich.:	ABCD14E16 (1)
Weight, g/mol:	377.85479
ΔH_f, kcal/mol:	-58.22
Dipole, Da:	1.01
IP(EA), eV:	-9.5(-0.83)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(4,5-dibromothiophen-2-yl)-(4-fluoro-2-methylphenyl)methanone

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1Br)C)C(=O)C2=C(C=C(C=C2)F)C

DOS

IR

Vibrations