Geometry & MOs

Info

ID:	401467
PubChem CID:	135051354
Reduced:	ClS2O4C11H11 (1)
Stoich.:	AB2C4D11E11 (1)
Weight, g/mol:	371.97697
ΔH_f, kcal/mol:	40.54
Dipole, Da:	11.4
IP(EA), eV:	-9.98(-3.7)
Spin(S_z, S²):	None, None
Charge, e:	1

Chem-info

IUPAC name:

dimethyl-[(2Z)-2-(4-methyl-5-phenyldiselenol-3-ylidene)propylidene]azanium

Drug info:

PubChemData

Smile

CCC1=S(SC(=C1)C2=CC=CC=C2)OCl(=O)(=O)=O

DOS

IR

Vibrations