Geometry & MOs

Info

ID:	288582
PubChem CID:	104320353
Reduced:	NOC8H10 (2)
Stoich.:	ABC8D10 (2)
Weight, g/mol:	262.142976
ΔH_f, kcal/mol:	-43.59
Dipole, Da:	6.49
IP(EA), eV:	-9.13(-0.57)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N'-hydroxy-6-(4-hydroxy-3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrol-2-yl)pyridine-3-carboximidamide

Drug info:

PubChemData

Smile

COC1=C(C=C(C=C1)CN2CC3CCC(C3C2)O)C#N

DOS

IR

Vibrations