Geometry & MOs

Info

ID:	184146
PubChem CID:	77118216
Reduced:	FO3N4C17H21 (1)
Stoich.:	AB3C4D17E21 (1)
Weight, g/mol:	234.136828
ΔH_f, kcal/mol:	-121.09
Dipole, Da:	3.79
IP(EA), eV:	-9.01(-0.28)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-tert-butyl-2-oxo-3,5,6,7-tetrahydrocyclopenta[b]pyridine-3-carboxamide

Drug info:

PubChemData

Smile

CC1C2C(CC(=O)N1NC(=O)C(C)C)NN(C2=O)C3=CC(=CC=C3)F

DOS

IR

Vibrations