Geometry & MOs

Info

ID:	389302
PubChem CID:	134992106
Reduced:	NSiTiCl2C19H21 (1)
Stoich.:	ABCD2E19F21 (1)
Weight, g/mol:	218.115424
ΔH_f, kcal/mol:	62.46
Dipole, Da:	17.43
IP(EA), eV:	-7.75(-1.42)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3aR,5R,6S,6aR)-5-(hydroxymethyl)-2,2,3a,6a-tetramethyl-5,6-dihydrofuro[2,3-d][1,3]dioxol-6-ol

Drug info:

PubChemData

Smile

C[C@H](C1=CC=CC=C1)[N-][Si](C)(C)C2=CC=C3[C]2C=CC=C3.Cl[Ti]Cl

DOS

IR

Vibrations