Geometry & MOs

Info

ID:	47150
PubChem CID:	10529988
Reduced:	O5C33H44 (1)
Stoich.:	A5B33C44 (1)
Weight, g/mol:	520.343555
ΔH_f, kcal/mol:	-216.4
Dipole, Da:	5.36
IP(EA), eV:	-8.77(-0.84)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1R,2S,3R,4S,5R)-2,3-bis[[tert-butyl(dimethyl)silyl]oxy]-5-(hydroxymethyl)-4-triethylsilyloxycyclohexan-1-ol

Drug info:

PubChemData

Smile

CCCCCCCCCCCCCCCCCC(=O)OC1=CC2=C(C=C1)C(=O)C(=CO2)C3=CC=C(C=C3)O

DOS

IR

Vibrations