Geometry & MOs

Info

ID:	5370
PubChem CID:	13056
Reduced:	NC13H26 (1)
Stoich.:	AB13C26 (1)
Weight, g/mol:	196.206525
ΔH_f, kcal/mol:	-10.57
Dipole, Da:	0.51
IP(EA), eV:	0.0(0.0)
Spin(S_z, S²):	0.500000, 0.750926
Charge, e:	1

Chem-info

IUPAC name:

3,3,9-trimethyl-3-azoniaspiro[5.5]undecane

Drug info:

PubChemData

Smile

CC1CCC2(CC1)CC[N+](CC2)(C)C

DOS

IR

Vibrations