Geometry & MOs

Info

ID:	142667
PubChem CID:	53073574
Reduced:	SF3N3O4H16C20 (1)
Stoich.:	AB3C3D4E16F20 (1)
Weight, g/mol:	423.125277
ΔH_f, kcal/mol:	-235.05
Dipole, Da:	10.51
IP(EA), eV:	-9.51(-1.53)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2,3-dihydro-1H-inden-5-yl)-2-[3-(3-methylphenyl)sulfonyl-6-oxopyridazin-1-yl]acetamide

Drug info:

PubChemData

Smile

CC1=CC(=CC=C1)S(=O)(=O)C2=NN(C(=O)C=C2)CC(=O)NC3=CC=C(C=C3)C(F)(F)F

DOS

IR

Vibrations