Geometry & MOs

Info

ID:	370674
PubChem CID:	127339836
Reduced:	ON4C23H28 (1)
Stoich.:	AB4C23D28 (1)
Weight, g/mol:	366.205576
ΔH_f, kcal/mol:	6.53
Dipole, Da:	3.38
IP(EA), eV:	-8.29(0.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[2-[4-(1-ethylpyrazol-4-yl)piperidin-1-yl]-2-oxoethyl]-3,4-dihydroquinolin-2-one

Drug info:

PubChemData

Smile

CCN1C=C(C=N1)C2CCN(CC2)C(=O)C3=CC4=C(C=C3)NC5=C4CCCC5

DOS

IR

Vibrations