Geometry & MOs

Info

ID:	391463
PubChem CID:	135005417
Reduced:	O3C11H18 (1)
Stoich.:	A3B11C18 (1)
Weight, g/mol:	334.156895
ΔH_f, kcal/mol:	-132.42
Dipole, Da:	2.36
IP(EA), eV:	-9.83(-0.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl (3R,4S,5S)-4-benzoyl-3-methyl-5-phenylcyclopentene-1-carboxylate

Drug info:

PubChemData

Smile

CCOC(=O)C(=C)C[C@H](C=O)C(C)C

DOS

IR

Vibrations