Geometry & MOs

Info

ID:

232744

PubChem CID:

87576857

Reduced:

O4N6C17H28 (1)

Stoich.:

A4B6C17D28 (1)

Weight, g/mol:

451.247107

ΔHf, kcal/mol:

-80.8

Dipole, Da:

6.02

IP(EA), eV:

-9.69(-0.6)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

ditert-butyl 2-(benzhydrylideneamino)imidazolidine-1,3-dicarboxylate

Drug info:

PubChemData

Smile

CC(C)(C#N)N=NC(C)(C)C#N.CC(C)(C(=O)O)N=NC(C)(C)C(=O)OC

DOS

IR

Vibrations