Geometry & MOs

Info

ID:

1445

PubChem CID:

4456

Reduced:

N2O2C12H19 (1)

Stoich.:

A2B2C12D19 (1)

Weight, g/mol:

223.144653

ΔHf, kcal/mol:

-30.6

Dipole, Da:

1.93

IP(EA), eV:

 0.0(0.0)

Spin(Sz, S2):

 0.500000, 0.775354

Charge, e:

 1

Chem-info

IUPAC name:

[3-(dimethylcarbamoyloxy)phenyl]-trimethylazanium

Drug info:

PubChemData

Smile

CN(C)C(=O)OC1=CC=CC(=C1)[N+](C)(C)C

DOS

IR

Vibrations