Geometry & MOs

Info

ID:	30175
PubChem CID:	840446
Reduced:	SN2O2C16H18 (1)
Stoich.:	AB2C2D16E18 (1)
Weight, g/mol:	242.028062
ΔH_f, kcal/mol:	-18.95
Dipole, Da:	5.34
IP(EA), eV:	-8.96(-0.52)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-chloro-N-(3-cyano-4-ethyl-5-methylthiophen-2-yl)acetamide

Drug info:

PubChemData

Smile

CCC(=NNS(=O)(=O)C1=CC=CC=C1)C2=CC=C(C=C2)C

DOS

IR

Vibrations