Geometry & MOs

Info

ID:	380703
PubChem CID:	134971230
Reduced:	NSO6C22H31 (1)
Stoich.:	ABC6D22E31 (1)
Weight, g/mol:	341.129694
ΔH_f, kcal/mol:	-253.33
Dipole, Da:	8.66
IP(EA), eV:	-8.62(-0.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-[(1R)-1-hydroxy-2-(3-methyl-1,1-dioxo-2,5-dihydrothiophen-2-yl)ethyl]-5-methyl-4-pyrrolidin-1-ylfuran-2-one

Drug info:

PubChemData

Smile

CC1=CCS(=O)(=O)C1C[C@H](C2(C(=CC(=O)O2)N3CCCC3)C)OC(=O)/C=C/C(C)C

DOS

IR

Vibrations