Geometry & MOs

Info

ID:	402006
PubChem CID:	135053826
Reduced:	NO4C15H17 (1)
Stoich.:	AB4C15D17 (1)
Weight, g/mol:	366.146724
ΔH_f, kcal/mol:	-111.78
Dipole, Da:	3.94
IP(EA), eV:	-9.2(-0.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl (1R,5R)-4-ethoxy-3-hydroxy-2-oxo-1,5-diphenylcyclopent-3-ene-1-carboxylate

Drug info:

PubChemData

Smile

CCOC(=O)C(CCC=O)(C#N)C1=CC=C(C=C1)OC

DOS

IR

Vibrations