Geometry & MOs

Info

ID:	394739
PubChem CID:	135023666
Reduced:	NOH23C27 (1)
Stoich.:	ABC23D27 (1)
Weight, g/mol:	389.162708
ΔH_f, kcal/mol:	80.61
Dipole, Da:	3.41
IP(EA), eV:	-8.4(-0.28)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(3R,4S,5S)-2-benzyl-5-methoxy-3-phenyl-1,2-oxazolidin-4-yl] benzoate

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)/C=C/C(C2=CC=CC=C2)NC3=CC=C(C=C3)OC4=CC=CC=C4

DOS

IR

Vibrations