Geometry & MOs

Info

ID:	220137
PubChem CID:	85165285
Reduced:	SiO8C37H58 (1)
Stoich.:	AB8C37D58 (1)
Weight, g/mol:	658.405352
ΔH_f, kcal/mol:	-325.73
Dipole, Da:	2.31
IP(EA), eV:	-8.55(-0.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[3-(1-acetyloxyoct-2-enyl)-5-[5-[tert-butyl(diphenyl)silyl]oxypentyl]-1,2,3,3a,4,6a-hexahydropentalen-2-yl] acetate

Drug info:

PubChemData

Smile

CC(C#CCC(C)(CC(C#CCCC(CCO[Si](C)(C)C(C)(C)C)C(=C)C)OC(=O)OC)OCOC)OCC1=CC=C(C=C1)OC

DOS

IR

Vibrations