Geometry & MOs

Info

ID:	44220
PubChem CID:	10502047
Reduced:	SN2O3C23H32 (1)
Stoich.:	AB2C3D23E32 (1)
Weight, g/mol:	416.238286
ΔH_f, kcal/mol:	-86.35
Dipole, Da:	7.89
IP(EA), eV:	-8.59(-0.39)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3S,4S,5R)-6-[tert-butyl(diphenyl)silyl]oxy-3,5-dimethylhexane-1,2,4-triol

Drug info:

PubChemData

Smile

CC(C)C1=CC(=C(C(=C1)C(C)C)S(=O)(=O)N/N=C/C2=CC(=CC=C2)OC)C(C)C

DOS

IR

Vibrations