Geometry & MOs

Info

ID:

322984

PubChem CID:

126671678

Reduced:

NOC16H24 (1)

Stoich.:

ABC16D24 (1)

Weight, g/mol:

276.23274

ΔHf, kcal/mol:

-6.24

Dipole, Da:

12.16

IP(EA), eV:

 0.0(0.0)

Spin(Sz, S2):

 0.500000, 1.050439

Charge, e:

 1

Chem-info

IUPAC name:

2-ethylhexyl-dimethyl-phenacylazanium

Drug info:

PubChemData

Smile

C[N+](C)(CC(=O)C1=CC=CC=C1)C2CCCCC2

DOS

IR

Vibrations