Geometry & MOs

Info

ID:	339107
PubChem CID:	127260364
Reduced:	O5C18H20 (1)
Stoich.:	A5B18C20 (1)
Weight, g/mol:	371.88197
ΔH_f, kcal/mol:	-168.37
Dipole, Da:	4.43
IP(EA), eV:	-9.43(-0.68)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3,5-dibromo-2-hydroxyphenyl) benzoate

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)COCCOC(COC(=O)C2=CC=CC=C2)O

DOS

IR

Vibrations