Geometry & MOs

Info

ID:	312813
PubChem CID:	126608870
Reduced:	SF3O6C14H15 (1)
Stoich.:	AB3C6D14E15 (1)
Weight, g/mol:	342.146724
ΔH_f, kcal/mol:	-370.73
Dipole, Da:	5.31
IP(EA), eV:	-9.18(-1.75)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl (E)-3-[2-[(4-methoxyphenoxy)methoxy]-4-methylphenyl]prop-2-enoate

Drug info:

PubChemData

Smile

CCOC1=CC(=C(C=C1)/C=C/C(=O)OCC)OS(=O)(=O)C(F)(F)F

DOS

IR

Vibrations