Geometry & MOs

Info

ID:	287534
PubChem CID:	104246315
Reduced:	ClNSO2H12C15 (1)
Stoich.:	ABCD2E12F15 (1)
Weight, g/mol:	278.174276
ΔH_f, kcal/mol:	-43.51
Dipole, Da:	6.55
IP(EA), eV:	-8.83(-1.07)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[6,7-dihydro-5H-cyclopenta[b]pyridin-2-yl(2-methoxyethyl)amino]-N'-hydroxypropanimidamide

Drug info:

PubChemData

Smile

C1CC2=C(C1)N=C(C=C2)SC3=CC(=C(C=C3)Cl)C(=O)O

DOS

IR

Vibrations