Geometry & MOs

Info

ID:	10190
PubChem CID:	98713
Reduced:	BrOH7C9 (1)
Stoich.:	ABC7D9 (1)
Weight, g/mol:	209.96803
ΔH_f, kcal/mol:	-14.44
Dipole, Da:	2.07
IP(EA), eV:	-9.84(-0.86)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-bromo-2,3-dihydroinden-1-one

Drug info:

PubChemData

Smile

C1CC(=O)C2=C1C(=CC=C2)Br

DOS

IR

Vibrations