Geometry & MOs

Info

ID:	56884
PubChem CID:	22394692
Reduced:	FSO2N5C17H22 (1)
Stoich.:	ABC2D5E17F22 (1)
Weight, g/mol:	521.128839
ΔH_f, kcal/mol:	-44.43
Dipole, Da:	6.3
IP(EA), eV:	-8.56(-0.42)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(E)-[[2-(4-chlorophenyl)-1-(4-methoxyphenyl)sulfonylindol-3-yl]-cyclopropylmethylidene]amino]guanidine

Drug info:

PubChemData

Smile

CCCCS(=O)(=O)N1C=C(C2=C1C=C(C=C2)F)/C(=N/N=C(N)N)/C3CC3

DOS

IR

Vibrations