Geometry & MOs

Info

ID:	233432
PubChem CID:	90744369
Reduced:	SO3N5C24H27 (1)
Stoich.:	AB3C5D24E27 (1)
Weight, g/mol:	248.989141
ΔH_f, kcal/mol:	-38.86
Dipole, Da:	7.5
IP(EA), eV:	-8.32(-0.88)
Spin(S_z, S²):	None, None
Charge, e:	-1

Chem-info

IUPAC name:

(2,5-dimethylphenyl)sulfonyl sulfite

Drug info:

PubChemData

Smile

CC1=NN(C2=C1C=C(S2)C(=O)NC3=CC=C(C=C3)CN4C(=CN(C4=O)C)O)C5CCCCC5

DOS

IR

Vibrations