Geometry & MOs

Info

ID:	161594
PubChem CID:	57392090
Reduced:	FO2S2N3H10C17 (1)
Stoich.:	AB2C2D3E10F17 (1)
Weight, g/mol:	443.303559
ΔH_f, kcal/mol:	27.72
Dipole, Da:	2.99
IP(EA), eV:	-9.07(-1.46)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(4S)-4-[(E,1R)-1-hydroxyhexadec-2-enyl]-3-(2-phenylacetyl)-1,3-oxazolidin-2-one

Drug info:

PubChemData

Smile

C1=CC(=CC(=C1)N=C=S)C2=NN=C(O2)SCC(=O)C3=CC=C(C=C3)F

DOS

IR

Vibrations