Geometry & MOs

Info

ID:	387723
PubChem CID:	134986589
Reduced:	NSiO2C13H25 (1)
Stoich.:	ABC2D13E25 (1)
Weight, g/mol:	223.097521
ΔH_f, kcal/mol:	-114.94
Dipole, Da:	4.76
IP(EA), eV:	-9.79(0.9)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(6R,7S,8aR)-8a-(hydroxymethyl)-1,2,3,4,5,6,7,8-octahydroindolizin-4-ium-6,7-diol;chloride

Drug info:

PubChemData

Smile

CC(OCC[Si](C)(C)C)OC(C=C(C)C)C#N

DOS

IR

Vibrations