Geometry & MOs

Info

ID:	336923
PubChem CID:	127255930
Reduced:	SiN3O6C22H31 (1)
Stoich.:	AB3C6D22E31 (1)
Weight, g/mol:	294.179087
ΔH_f, kcal/mol:	-217.79
Dipole, Da:	3.86
IP(EA), eV:	-8.68(-0.4)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2R)-2-amino-6-[[(2R,3S,4R)-2,4,5-trihydroxy-3-methoxypentyl]amino]hexanoic acid

Drug info:

PubChemData

Smile

COC1=CC(=NC(=N1)OC2=CC=CC(=C2C(=O)OCC[Si](C)(C)C)N3CCOCC3)OC

DOS

IR

Vibrations