Geometry & MOs

Info

ID:	339123
PubChem CID:	127260502
Reduced:	O4H14C15 (1)
Stoich.:	A4B14C15 (1)
Weight, g/mol:	278.188195
ΔH_f, kcal/mol:	-120.38
Dipole, Da:	2.42
IP(EA), eV:	-8.98(-0.79)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-hydroxydecyl benzoate

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)C(=O)OCCOC2=CC=CC(=C2)O

DOS

IR

Vibrations