Geometry & MOs

Info

ID:	396226
PubChem CID:	135027753
Reduced:	SiO3C16H28 (2)
Stoich.:	AB3C16D28 (2)
Weight, g/mol:	193.067382
ΔH_f, kcal/mol:	-313.21
Dipole, Da:	3.82
IP(EA), eV:	-8.68(0.29)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

sodium;3,3-dideuterio-2-oxo-3-(2,4,6-trideuterio(3,5-13C2)cyclohexa-1,3,5-trien-1-yl)propanoate

Drug info:

PubChemData

Smile

C[C@@H](CO[Si](C)(C)C(C)(C)C)/C=C/C[C@](C)([C@@H](C[C@H](C#C[Si](C)(C)C)O)OCOC)OCC1=CC=C(C=C1)OC

DOS

IR

Vibrations