Geometry & MOs

Info

ID:	19392
PubChem CID:	562883
Reduced:	NSO2C8H9 (3)
Stoich.:	ABC2D8E9 (3)
Weight, g/mol:	549.106199
ΔH_f, kcal/mol:	-178.16
Dipole, Da:	5.72
IP(EA), eV:	-9.54(-0.63)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1,3,5-tris[(2-methylphenyl)sulfonyl]-1,3,5-triazinane

Drug info:

PubChemData

Smile

CC1=CC=CC=C1S(=O)(=O)N2CN(CN(C2)S(=O)(=O)C3=CC=CC=C3C)S(=O)(=O)C4=CC=CC=C4C

DOS

IR

Vibrations