Geometry & MOs

Info

ID:

291206

PubChem CID:

111978158

Reduced:

O3N5C24H37 (1)

Stoich.:

A3B5C24D37 (1)

Weight, g/mol:

482.11787

ΔHf, kcal/mol:

-121.4

Dipole, Da:

4.72

IP(EA), eV:

-9.24(0.39)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

methyl 4-[[N'-methyl-N-(naphthalen-1-ylmethyl)carbamimidoyl]amino]piperidine-1-carboxylate;hydroiodide

Drug info:

PubChemData

Smile

CCNC(=NCC(=O)N1CCC(CC1)CC2=CC=CC=C2)NC3CCN(CC3)C(=O)OC

DOS

IR

Vibrations