Geometry & MOs

Info

ID:	18547
PubChem CID:	542646
Reduced:	O2C9H9 (2)
Stoich.:	A2B9C9 (2)
Weight, g/mol:	298.120509
ΔH_f, kcal/mol:	-110.78
Dipole, Da:	2.43
IP(EA), eV:	-8.61(-0.43)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[4-[2-[2-(methoxymethoxy)phenyl]ethenyl]phenyl] acetate

Drug info:

PubChemData

Smile

CC(=O)OC1=CC=C(C=C1)C=CC2=CC=CC=C2OCOC

DOS

IR

Vibrations