Geometry & MOs

Info

ID:	437569
PubChem CID:	135226614
Reduced:	ClOSN2H19C22 (1)
Stoich.:	ABCD2E19F22 (1)
Weight, g/mol:	343.106457
ΔH_f, kcal/mol:	39.78
Dipole, Da:	3.77
IP(EA), eV:	-8.64(-1.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(NE,R)-2-methyl-N-[1-(8-methyldibenzothiophen-2-yl)ethylidene]propane-2-sulfinamide

Drug info:

PubChemData

Smile

CC#CC1=CC2=C(C=C1)SC3=CC(=C(C=C32)[C@@]4(CC(=O)N(C(=C)N4)C)C)Cl

DOS

IR

Vibrations