Geometry & MOs

Info

ID:	392832
PubChem CID:	135018137
Reduced:	SiN2O3H32C34 (1)
Stoich.:	AB2C3D32E34 (1)
Weight, g/mol:	678.200729
ΔH_f, kcal/mol:	-29.47
Dipole, Da:	4.94
IP(EA), eV:	-8.55(-0.21)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(3R,6S)-4,5,6-triacetyloxy-3-[(2S,5R)-3,4,5-triacetyloxy-6-(acetyloxymethyl)oxan-2-yl]oxyoxan-2-yl]methyl acetate

Drug info:

PubChemData

Smile

COC(=O)[C@H](CC1=CNC2=CC=CC=C21)NC(=O)/C=C/C[Si](C3=CC=CC=C3)(C4=CC=CC=C4)C5=CC=CC=C5

DOS

IR

Vibrations