Geometry & MOs

Info

ID:	9976
PubChem CID:	95697
Reduced:	O5C13H16 (1)
Stoich.:	A5B13C16 (1)
Weight, g/mol:	252.099774
ΔH_f, kcal/mol:	-203.49
Dipole, Da:	3.27
IP(EA), eV:	-8.92(0.25)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2-acetyloxy-3-phenoxypropyl) acetate

Drug info:

PubChemData

Smile

CC(=O)OCC(COC1=CC=CC=C1)OC(=O)C

DOS

IR

Vibrations