Geometry & MOs

Info

ID:	438699
PubChem CID:	135228450
Reduced:	OSC10H10 (1)
Stoich.:	ABC10D10 (1)
Weight, g/mol:	210.089209
ΔH_f, kcal/mol:	1.23
Dipole, Da:	4.97
IP(EA), eV:	-9.72(-0.7)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 4-(hydroxymethyl)-2-methoxy-5-methylbenzoate

Drug info:

PubChemData

Smile

C1CC1C2=CC=C(C=C2)C(=O)S

DOS

IR

Vibrations