Geometry & MOs

Info

ID:

406751

PubChem CID:

135078523

Reduced:

ON2C12H21 (1)

Stoich.:

AB2C12D21 (1)

Weight, g/mol:

252.101111

ΔHf, kcal/mol:

-43.71

Dipole, Da:

4.41

IP(EA), eV:

 0.0(0.0)

Spin(Sz, S2):

 0.500000, 0.781639

Charge, e:

 0

Chem-info

IUPAC name:

(E)-1-(2-azidophenyl)-N-methoxy-1-phenylmethanimine

Drug info:

PubChemData

Smile

CC1(CC(=O)N[N+]1=CC2CCCCC2)C

DOS

IR

Vibrations