Geometry & MOs

Info

ID:	388016
PubChem CID:	134987867
Reduced:	O3C14H16 (1)
Stoich.:	A3B14C16 (1)
Weight, g/mol:	229.110279
ΔH_f, kcal/mol:	-97.85
Dipole, Da:	2.03
IP(EA), eV:	-10.01(-0.75)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(4R)-3-ethynyl-4-phenyl-4-propan-2-yl-1,3-oxazolidin-2-one

Drug info:

PubChemData

Smile

CC(CC=O)C(C(=O)C)C(=O)C1=CC=CC=C1

DOS

IR

Vibrations