Geometry & MOs

Info

ID:	25942
PubChem CID:	634419
Reduced:	SiO2C26H42 (1)
Stoich.:	AB2C26D42 (1)
Weight, g/mol:	416.17763
ΔH_f, kcal/mol:	-179.03
Dipole, Da:	2.34
IP(EA), eV:	-8.53(0.6)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,32-dioxaheptacyclo[18.12.0.01,14.03,12.06,11.022,31.023,28]dotriaconta-3(12),4,6,8,10,13,20,22(31),23,25,27,29-dodecaene

Drug info:

PubChemData

Smile

CCCCCC1=CC2=C(C3C=C(CCC3C(O2)(C)C)C)C(=C1)O[Si](C)(C)CCC

DOS

IR

Vibrations