Geometry & MOs

Info

ID:	440805
PubChem CID:	135231555
Reduced:	FSO3N4H23C24 (1)
Stoich.:	ABC3D4E23F24 (1)
Weight, g/mol:	351.1293
ΔH_f, kcal/mol:	-63.64
Dipole, Da:	2.65
IP(EA), eV:	-8.48(-0.86)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(NE)-2-methyl-N-[1-(8-prop-1-ynyldibenzofuran-2-yl)ethylidene]propane-2-sulfinamide

Drug info:

PubChemData

Smile

CC1=NC(=NN1CC2=CC(=CC=C2)C(=O)OC)C3=NC(=CS3)C4=CC=C(C=C4)OC(C)(C)F

DOS

IR

Vibrations