Geometry & MOs

Info

ID:	219696
PubChem CID:	85164569
Reduced:	O6C35H46 (1)
Stoich.:	A6B35C46 (1)
Weight, g/mol:	562.336591
ΔH_f, kcal/mol:	-40.83
Dipole, Da:	7.82
IP(EA), eV:	-8.3(-0.42)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl-[6-[tert-butyl(dimethyl)silyl]oxy-9-(1,3-dithian-2-yl)-4-methoxy-3-methyldec-2-enoxy]-dimethylsilane

Drug info:

PubChemData

Smile

CC1=CC(=CC2=C1CC3(CC(C4(C(CC5=C(O4)C=C(C(=O)C=C5C)O)(CC(C=CCC3(O2)C)(C)C)C)C)O)C)OC

DOS

IR

Vibrations