Geometry & MOs

Info

ID:

11462

PubChem CID:

115903

Reduced:

N2O2C13H21 (1)

Stoich.:

A2B2C13D21 (1)

Weight, g/mol:

237.160303

ΔHf, kcal/mol:

-45.91

Dipole, Da:

1.65

IP(EA), eV:

 0.0(0.0)

Spin(Sz, S2):

 0.500000, 0.751798

Charge, e:

 1

Chem-info

IUPAC name:

2-(benzylcarbamoyloxy)ethyl-trimethylazanium

Drug info:

PubChemData

Smile

C[N+](C)(C)CCOC(=O)NCC1=CC=CC=C1

DOS

IR

Vibrations