Geometry & MOs

Info

ID:	303462
PubChem CID:	124489764
Reduced:	NO4H23C28 (1)
Stoich.:	AB4C23D28 (1)
Weight, g/mol:	259.033686
ΔH_f, kcal/mol:	-81.36
Dipole, Da:	4.28
IP(EA), eV:	-8.88(-1.07)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(4S,6R)-6-methyl-7,7-dioxo-5,6-dihydro-4H-thieno[2,3-b]thiopyran-4-yl]acetamide

Drug info:

PubChemData

Smile

C[C@](C1=CC=CC2=CC=CC=C21)(C(=O)O)NC(=O)OCC3C4=CC=CC=C4C5=CC=CC=C35

DOS

IR

Vibrations