Geometry & MOs

Info

ID:	17998
PubChem CID:	532489
Reduced:	BrO3H11C14 (1)
Stoich.:	AB3C11D14 (1)
Weight, g/mol:	305.98916
ΔH_f, kcal/mol:	-61.67
Dipole, Da:	1.37
IP(EA), eV:	-8.64(-0.82)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(4-methoxyphenyl) 2-bromobenzoate

Drug info:

PubChemData

Smile

COC1=CC=C(C=C1)OC(=O)C2=CC=CC=C2Br

DOS

IR

Vibrations