Geometry & MOs

Info

ID:	56881
PubChem CID:	22394682
Reduced:	FSO2N5C15H20 (1)
Stoich.:	ABC2D5E15F20 (1)
Weight, g/mol:	411.149574
ΔH_f, kcal/mol:	-67.1
Dipole, Da:	5.62
IP(EA), eV:	-8.71(-0.31)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(Z)-1-(1-butylsulfonyl-5-chloroindol-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)C

DOS

IR

Vibrations