Geometry & MOs

Info

ID:	38260
PubChem CID:	8028514
Reduced:	NO5C23H25 (1)
Stoich.:	AB5C23D25 (1)
Weight, g/mol:	340.055149
ΔH_f, kcal/mol:	-179.18
Dipole, Da:	6.15
IP(EA), eV:	-9.41(-0.79)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(3aR,6aR)-3-(4-methoxyphenyl)-5,5-dioxo-3a,4,6,6a-tetrahydrothieno[3,4-d][1,3]thiazol-2-ylidene]acetamide

Drug info:

PubChemData

Smile

CCC1=CC(=O)OC2=C1C(=CC(=C2)C)O[C@@H](C)C(=O)NC[C@H](C3=CC=CC=C3)O

DOS

IR

Vibrations