Geometry & MOs

Info

ID:

11028

PubChem CID:

110120

Reduced:

NC14H20 (1)

Stoich.:

AB14C20 (1)

Weight, g/mol:

202.159575

ΔHf, kcal/mol:

4.06

Dipole, Da:

1.35

IP(EA), eV:

 0.0(0.0)

Spin(Sz, S2):

 0.500000, 0.888147

Charge, e:

 1

Chem-info

IUPAC name:

1-ethyl-2,3,3,5-tetramethylindol-1-ium

Drug info:

PubChemData

Smile

CC[N+]1=C(C(C2=C1C=CC(=C2)C)(C)C)C

DOS

IR

Vibrations