Geometry & MOs

Info

ID:	122583
PubChem CID:	50813294
Reduced:	SN4O4H20C26 (1)
Stoich.:	AB4C4D20E26 (1)
Weight, g/mol:	432.216141
ΔH_f, kcal/mol:	7.23
Dipole, Da:	5.81
IP(EA), eV:	-8.46(-1.3)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-[1-(2,4-dimethylanilino)-1-oxopropan-2-yl]-3-oxo-6-phenylpyridazin-4-yl]-2-methylpropanamide

Drug info:

PubChemData

Smile

C1OC2=C(O1)C=C(C=C2)NC(=O)CSC3=NN=C(N3CC4=CC=CC=C4)C5=CC6=CC=CC=C6O5

DOS

IR

Vibrations