Geometry & MOs

Info

ID:	214489
PubChem CID:	85083117
Reduced:	FSN2O6C27H41 (1)
Stoich.:	ABC2D6E27F41 (1)
Weight, g/mol:	540.272728
ΔH_f, kcal/mol:	-288.22
Dipole, Da:	7.69
IP(EA), eV:	-8.83(-0.51)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2-(1,3-benzodioxol-5-yl)-7-[tert-butyl(dimethyl)silyl]oxy-5-(methoxymethoxy)hepta-1,3-dienyl]-dimethyl-phenylsilane

Drug info:

PubChemData

Smile

CCC1C(C(CCCC2(C(O2)CC(OC(=O)CC(C(C1=O)(C)C)O)C(=CC3=CSC(=N3)CN)F)C)C)O

DOS

IR

Vibrations