Geometry & MOs

Info

ID:	23331
PubChem CID:	603117
Reduced:	BrO3H9C14 (1)
Stoich.:	AB3C9D14 (1)
Weight, g/mol:	303.97351
ΔH_f, kcal/mol:	-49.81
Dipole, Da:	2.76
IP(EA), eV:	-9.75(-1.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3-formylphenyl) 3-bromobenzoate

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations