Geometry & MOs

Info

ID:	219683
PubChem CID:	85164484
Reduced:	SiO7C31H42 (1)
Stoich.:	AB7C31D42 (1)
Weight, g/mol:	554.342751
ΔH_f, kcal/mol:	-287.16
Dipole, Da:	2.56
IP(EA), eV:	-9.01(0.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-O-tert-butyl 5-O-(2-trimethylsilylethyl) 2-butyl-4-[2-(4-phenylmethoxyphenyl)ethyl]pentanedioate

Drug info:

PubChemData

Smile

CCOC(C#CC1(C2C(C(O1)CO[Si](C3=CC=CC=C3)(C4=CC=CC=C4)C(C)(C)C)OC(O2)(C)C)O)OCC

DOS

IR

Vibrations