Geometry & MOs

Info

ID:	220082
PubChem CID:	85165221
Reduced:	ISi3O5C25H55 (1)
Stoich.:	AB3C5D25E55 (1)
Weight, g/mol:	650.202562
ΔH_f, kcal/mol:	-414.74
Dipole, Da:	1.28
IP(EA), eV:	-8.64(-1.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(butoxymethyl)-5-hydroxypyran-4-one;iron

Drug info:

PubChemData

Smile

CC(C)(C)[Si](C)(C)OC1C(OC(C(C1O[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C)OC)CI

DOS

IR

Vibrations