Geometry & MOs

Info

ID:

182015

PubChem CID:

76828000

Reduced:

N3O5C27H29 (1)

Stoich.:

A3B5C27D29 (1)

Weight, g/mol:

244.072703

ΔHf, kcal/mol:

-110.74

Dipole, Da:

5.97

IP(EA), eV:

-8.79(-0.6)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

5-chloro-N'-hydroxy-6-(2-methoxyethylamino)pyridine-3-carboximidamide

Drug info:

PubChemData

Smile

CN1C2=C(C=N1)C3(CCN(CC3)C(=O)C4=CC(=C(C=C4)OC5CCOC5)OC)OC6=CC=CC=C62

DOS

IR

Vibrations