Geometry & MOs

Info

ID:	384346
PubChem CID:	134976825
Reduced:	SiO4C29H48 (1)
Stoich.:	AB4C29D48 (1)
Weight, g/mol:	628.525073
ΔH_f, kcal/mol:	-212.04
Dipole, Da:	2.82
IP(EA), eV:	-8.97(0.58)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3R)-26-[tert-butyl(dimethyl)silyl]oxy-25-methyl-1-phenylmethoxyhexacos-21-yn-3-ol

Drug info:

PubChemData

Smile

CCCC[C@H]1[C@@H](CC(=O)[C@@H]1CC#CC#CCCCCOC2CCCCO2)O[Si](C)(C)C(C)(C)C

DOS

IR

Vibrations