Geometry & MOs

Info

ID:	385551
PubChem CID:	134979387
Reduced:	NO7C17H17 (1)
Stoich.:	AB7C17D17 (1)
Weight, g/mol:	355.1815
ΔH_f, kcal/mol:	-179.81
Dipole, Da:	2.64
IP(EA), eV:	-10.36(-1.99)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl (1R,2R)-4-[tert-butyl(dimethyl)silyl]oxy-2-(2-oxo-1,3-oxazolidin-3-yl)cyclohex-3-ene-1-carboxylate

Drug info:

PubChemData

Smile

CC(=O)[C@@]1(CCC=C[C@H]1C(=O)OC)OC(=O)C2=CC=C(C=C2)[N+](=O)[O-]

DOS

IR

Vibrations