Geometry & MOs

Info

ID:	23373
PubChem CID:	603228
Reduced:	BrO3H7C9 (1)
Stoich.:	AB3C7D9 (1)
Weight, g/mol:	241.95786
ΔH_f, kcal/mol:	-83.23
Dipole, Da:	2.59
IP(EA), eV:	-10.13(-1.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2-(4-bromophenyl)-2-oxoethyl] formate

Drug info:

PubChemData

Smile

C1=CC(=CC=C1C(=O)COC=O)Br

DOS

IR

Vibrations