Geometry & MOs

Info

ID:	326413
PubChem CID:	126687500
Reduced:	N2O2H16C17 (1)
Stoich.:	A2B2C16D17 (1)
Weight, g/mol:	311.86198
ΔH_f, kcal/mol:	-17.04
Dipole, Da:	6.02
IP(EA), eV:	-9.2(-0.79)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-bromo-1-(3-bromo-5-fluoro-4-hydroxyphenyl)ethanone

Drug info:

PubChemData

Smile

CCC1=C(N2C=CC=CC2=N1)C(=O)C3=CC(=C(C=C3)O)C

DOS

IR

Vibrations