Geometry & MOs

Info

ID:	399160
PubChem CID:	135038374
Reduced:	O3C13H18 (1)
Stoich.:	A3B13C18 (1)
Weight, g/mol:	217.073893
ΔH_f, kcal/mol:	-133.67
Dipole, Da:	0.89
IP(EA), eV:	-9.43(0.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3E)-3-[(4R)-2-oxo-4-phenyl-1,3-oxazolidin-3-ium-3-ylidene]prop-1-en-2-olate

Drug info:

PubChemData

Smile

CCOC(CCC1=CC=CC=C1)OC(=O)C

DOS

IR

Vibrations