Geometry & MOs

Info

ID:	314228
PubChem CID:	126620958
Reduced:	NSO3C28H43 (1)
Stoich.:	ABC3D28E43 (1)
Weight, g/mol:	351.202071
ΔH_f, kcal/mol:	-121.45
Dipole, Da:	3.09
IP(EA), eV:	-8.92(-0.21)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(1-cyclobutylidenepropyl)-2-(2-methyl-4-propylphenyl)sulfanylaniline

Drug info:

PubChemData

Smile

C=C/C=C\C1=C(N(C(=O)C1C2CCCCCCCCC2)S(=O)(=O)C3CCCCCCC3)C=C

DOS

IR

Vibrations