Geometry & MOs

Info

ID:	22272
PubChem CID:	596473
Reduced:	O5C11H12 (1)
Stoich.:	A5B11C12 (1)
Weight, g/mol:	224.068473
ΔH_f, kcal/mol:	-203.18
Dipole, Da:	3.1
IP(EA), eV:	-9.44(-0.84)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 2-hydroxy-6-(2-methoxy-2-oxoethyl)benzoate

Drug info:

PubChemData

Smile

COC(=O)CC1=C(C(=CC=C1)O)C(=O)OC

DOS

IR

Vibrations