Geometry & MOs

Info

ID:	406494
PubChem CID:	135077814
Reduced:	NSSiO3C20H31 (1)
Stoich.:	ABCD3E20F31 (1)
Weight, g/mol:	268.032362
ΔH_f, kcal/mol:	-109.48
Dipole, Da:	5.94
IP(EA), eV:	-8.74(-0.59)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

disodium;1-(2-carboxylatoprop-2-enyl)-4-hydroxycyclohexa-2,5-diene-1-carboxylate

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)S(=O)(=O)N(C/C=C\CO[Si](C)(C)C(C)(C)C)CC#C

DOS

IR

Vibrations