Geometry & MOs

Info

ID:	352165
PubChem CID:	127283233
Reduced:	SO3N4C17H28 (1)
Stoich.:	AB3C4D17E28 (1)
Weight, g/mol:	286.179361
ΔH_f, kcal/mol:	-108.77
Dipole, Da:	8.36
IP(EA), eV:	-9.06(-0.51)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[2-(3-methylmorpholin-4-yl)ethylamino]-6,7-dihydro-5H-cyclopenta[b]pyridine-3-carbonitrile

Drug info:

PubChemData

Smile

CC1COCCN1CCNC2=NC=C(C=C2)S(=O)(=O)N3CCCCC3

DOS

IR

Vibrations