Geometry & MOs

Info

ID:	338783
PubChem CID:	127259794
Reduced:	NO3H23C26 (1)
Stoich.:	AB3C23D26 (1)
Weight, g/mol:	208.109944
ΔH_f, kcal/mol:	-5.38
Dipole, Da:	2.2
IP(EA), eV:	-9.04(-0.25)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-ethoxyethyl 2-phenylacetate

Drug info:

PubChemData

Smile

CC1=C(C=C(C=C1)C(C#N)(C2CC2)OC(=O)CC3=CC=CC=C3)OC4=CC=CC=C4

DOS

IR

Vibrations