Geometry & MOs

Info

ID:

27

PubChem CID:

1979

Reduced:

NO2C9H15 (1)

Stoich.:

AB2C9D15 (1)

Weight, g/mol:

169.110279

ΔHf, kcal/mol:

-101.92

Dipole, Da:

2.72

IP(EA), eV:

-9.0(0.76)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

1-azabicyclo[2.2.2]octan-3-yl acetate

Drug info:

PubChemData

Smile

CC(=O)OC1CN2CCC1CC2

DOS

IR

Vibrations