Geometry & MOs

Info

ID:	413729
PubChem CID:	135086679
Reduced:	ClO2S2H15C17 (1)
Stoich.:	AB2C2D15E17 (1)
Weight, g/mol:	374.0785
ΔH_f, kcal/mol:	5.4
Dipole, Da:	7.94
IP(EA), eV:	-8.78(-1.13)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(3,4-dimethylphenyl)-2-[2-(3,4-dimethylphenyl)-2-oxoethyl]selanylethanone

Drug info:

PubChemData

Smile

CCC(=CC#CC1=CC=C(C=C1)Cl)CS(=O)(=O)C2=CC=CS2

DOS

IR

Vibrations