Geometry & MOs

Info

ID:	56880
PubChem CID:	22394681
Reduced:	FSO2N5C24H24 (1)
Stoich.:	ABC2D5E24F24 (1)
Weight, g/mol:	353.132174
ΔH_f, kcal/mol:	-16.29
Dipole, Da:	8.27
IP(EA), eV:	-8.49(-1.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(Z)-1-(6-fluoro-1-methylsulfonylindol-3-yl)pentylideneamino]guanidine

Drug info:

PubChemData

Smile

CCCC/C(=N/N=C(N)N)/C1=CN(C2=C1C=CC(=C2)F)S(=O)(=O)C3=CC4=CC=CC=C4C=C3

DOS

IR

Vibrations