Geometry & MOs

Info

ID:	232211
PubChem CID:	87575720
Reduced:	BrClFO2H13C16 (1)
Stoich.:	ABCD2E13F16 (1)
Weight, g/mol:	328.89965
ΔH_f, kcal/mol:	-92.86
Dipole, Da:	2.29
IP(EA), eV:	-9.24(-1.09)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

None

Drug info:

PubChemData

Smile

CC(=O)C(C1=C(C(=C(C=C1)OC)C2=CC(=CC=C2)Cl)F)Br

DOS

IR

Vibrations