Geometry & MOs

Info

ID:	70097
PubChem CID:	47207581
Reduced:	INSO3C11H14 (1)
Stoich.:	ABCD3E11F14 (1)
Weight, g/mol:	295.124215
ΔH_f, kcal/mol:	-102.87
Dipole, Da:	1.72
IP(EA), eV:	-9.24(-0.89)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-propylsulfonyl-N-(1,2,3,4-tetrahydronaphthalen-1-yl)acetamide

Drug info:

PubChemData

Smile

CCCS(=O)(=O)CC(=O)NC1=CC(=CC=C1)I

DOS

IR

Vibrations