Geometry & MOs

Info

ID:	222310
PubChem CID:	85296646
Reduced:	SiO2C21H38 (1)
Stoich.:	AB2C21D38 (1)
Weight, g/mol:	351.168188
ΔH_f, kcal/mol:	-125.48
Dipole, Da:	0.52
IP(EA), eV:	-9.6(1.09)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

benzyl 2,3,4-trimethoxy-5-methyl-8-oxa-6-azabicyclo[3.2.1]octane-6-carboxylate

Drug info:

PubChemData

Smile

C[Si](C)(C)C#CCCCCC=CCCCCCOC1CCCCO1

DOS

IR

Vibrations