Geometry & MOs

Info

ID:	203528
PubChem CID:	79841298
Reduced:	ClN3C13H20 (1)
Stoich.:	AB3C13D20 (1)
Weight, g/mol:	312.125612
ΔH_f, kcal/mol:	7.3
Dipole, Da:	5.72
IP(EA), eV:	-8.78(-0.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N'-hydroxy-2-[methyl(2-methylsulfonylethyl)amino]-6,7-dihydro-5H-cyclopenta[b]pyridine-3-carboximidamide

Drug info:

PubChemData

Smile

CC(CNC1=C(C=NC=C1)Cl)CN2CCCC2

DOS

IR

Vibrations