Geometry & MOs

Info

ID:

144871

PubChem CID:

53426780

Reduced:

NOC14H20 (1)

Stoich.:

ABC14D20 (1)

Weight, g/mol:

237.128427

ΔHf, kcal/mol:

-7.62

Dipole, Da:

3.04

IP(EA), eV:

 0.0(0.0)

Spin(Sz, S2):

 0.500000, 0.758604

Charge, e:

 0

Chem-info

IUPAC name:

None

Drug info:

PubChemData

Smile

CCCOC1(CC[N+]CC1)C2=CC=CC=C2

DOS

IR

Vibrations