Geometry & MOs

Info

ID:	395972
PubChem CID:	135027046
Reduced:	N2O6C29H32 (1)
Stoich.:	A2B6C29D32 (1)
Weight, g/mol:	538.187064
ΔH_f, kcal/mol:	-130.79
Dipole, Da:	1.95
IP(EA), eV:	-9.61(-0.4)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

benzyl (3S,5S)-5-butyl-3-(4-chlorophenyl)-5-(phenylmethoxycarbonylaminooxy)-1,2-oxazolidine-2-carboxylate

Drug info:

PubChemData

Smile

CCCCC1(CC(N(O1)C(=O)OCC2=CC=CC=C2)C3=CC=CC=C3)N(C(=O)OCC4=CC=CC=C4)O

DOS

IR

Vibrations