Geometry & MOs

Info

ID:	301914
PubChem CID:	123100594
Reduced:	NSO3C11H15 (1)
Stoich.:	ABC3D11E15 (1)
Weight, g/mol:	295.087829
ΔH_f, kcal/mol:	-86.65
Dipole, Da:	5.58
IP(EA), eV:	-8.61(-0.07)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-benzyl-2-(2,4-dioxopentan-3-ylsulfinyl)acetamide

Drug info:

PubChemData

Smile

COCS(=O)CC(=O)NCC1=CC=CC=C1

DOS

IR

Vibrations