Geometry & MOs

Info

ID:	237974
PubChem CID:	92723334
Reduced:	S2N3O3H15C17 (1)
Stoich.:	A2B3C3D15E17 (1)
Weight, g/mol:	373.055484
ΔH_f, kcal/mol:	-24.77
Dipole, Da:	3.45
IP(EA), eV:	-8.57(-1.63)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[5-[[(2S)-2-methyl-2,3-dihydroindol-1-yl]sulfonyl]thiophen-2-yl]-1H-pyridazin-6-one

Drug info:

PubChemData

Smile

C[C@@H]1CC2=CC=CC=C2N1S(=O)(=O)C3=CC=C(S3)C4=NNC(=O)C=C4

DOS

IR

Vibrations