Geometry & MOs

Info

ID:	305503
PubChem CID:	124957816
Reduced:	N2O3C19H20 (1)
Stoich.:	A2B3C19D20 (1)
Weight, g/mol:	340.189926
ΔH_f, kcal/mol:	-63.49
Dipole, Da:	6.61
IP(EA), eV:	-9.12(-0.52)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-methyl-2-[2-[(2R)-2-[2-(2-methylpyridin-4-yl)ethyl]pyrrolidin-1-yl]-2-oxoethyl]pyridazin-3-one

Drug info:

PubChemData

Smile

C1C[C@H](N(C1)C(=O)C2=CC3=C(C=C2)OCO3)CCC4=CC=NC=C4

DOS

IR

Vibrations