Geometry & MOs

Info

ID:	287582
PubChem CID:	104247712
Reduced:	FN2O3H13C15 (1)
Stoich.:	AB2C3D13E15 (1)
Weight, g/mol:	294.032668
ΔH_f, kcal/mol:	-57.01
Dipole, Da:	8.09
IP(EA), eV:	-9.0(-1.62)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[(3,6-dichloropyridin-2-yl)methyl]-6,7-dihydro-5H-cyclopenta[b]pyridin-2-one

Drug info:

PubChemData

Smile

C1CC2=C(C1)N(C(=O)C=C2)CC3=CC(=C(C=C3)[N+](=O)[O-])F

DOS

IR

Vibrations