Geometry & MOs

Info

ID:	339119
PubChem CID:	127260498
Reduced:	FO3C12H15 (1)
Stoich.:	AB3C12D15 (1)
Weight, g/mol:	270.089209
ΔH_f, kcal/mol:	-170.45
Dipole, Da:	3.45
IP(EA), eV:	-10.16(-0.71)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3-formyl-4-methoxyphenyl)methyl benzoate

Drug info:

PubChemData

Smile

C[C@@H](COC(=O)C1=CC=CC=C1)C(CO)F

DOS

IR

Vibrations