Geometry & MOs

Info

ID:	408680
PubChem CID:	135081448
Reduced:	OC20H20 (1)
Stoich.:	AB20C20 (1)
Weight, g/mol:	281.126323
ΔH_f, kcal/mol:	22.6
Dipole, Da:	2.45
IP(EA), eV:	-9.04(0.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl (1S,6S)-3-methyl-6-(2-oxo-1,3-oxazolidine-3-carbonyl)cyclohex-3-ene-1-carboxylate

Drug info:

PubChemData

Smile

C[C@]12[C@](O1)(C3(C4=CC=CC=C4C2(C5=CC=CC=C53)C)C)C

DOS

IR

Vibrations