Geometry & MOs

Info

ID:	70017
PubChem CID:	47206785
Reduced:	SN3O4C9H11 (1)
Stoich.:	AB3C4D9E11 (1)
Weight, g/mol:	280.994713
ΔH_f, kcal/mol:	-53.66
Dipole, Da:	4.37
IP(EA), eV:	-10.51(-0.65)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(5-chlorothiophen-2-yl)methylsulfonyl]-N-methylpropanamide

Drug info:

PubChemData

Smile

CC1=NOC(=C1)CS(=O)(=O)CC2=NC(=NO2)C

DOS

IR

Vibrations