Geometry & MOs

Info

ID:	70086
PubChem CID:	47207503
Reduced:	NSO5C11H13 (1)
Stoich.:	ABC5D11E13 (1)
Weight, g/mol:	247.033686
ΔH_f, kcal/mol:	-176.23
Dipole, Da:	2.89
IP(EA), eV:	-8.68(-0.46)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-ethylsulfonyl-N-(thiophen-2-ylmethyl)acetamide

Drug info:

PubChemData

Smile

CCS(=O)(=O)CC(=O)NC1=CC2=C(C=C1)OCO2

DOS

IR

Vibrations