Geometry & MOs

Info

ID:	334656
PubChem CID:	127253331
Reduced:	ON4C15H22 (1)
Stoich.:	AB4C15D22 (1)
Weight, g/mol:	471.075466
ΔH_f, kcal/mol:	-11.12
Dipole, Da:	4.7
IP(EA), eV:	-8.72(0.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S,5'R)-7-chloro-3'-[[(3R,4S)-4-hydroxy-1,1-dioxothiolan-3-yl]amino]-4,6-dimethoxy-5'-methylspiro[1-benzofuran-2,6'-cyclohex-2-ene]-1',3-dione

Drug info:

PubChemData

Smile

C1=CN(C=C1)CCCCCC(=O)NCCC2=CN=CN2

DOS

IR

Vibrations