Geometry & MOs

Info

ID:	183326
PubChem CID:	77007884
Reduced:	SN2O4C14H18 (1)
Stoich.:	AB2C4D14E18 (1)
Weight, g/mol:	246.136828
ΔH_f, kcal/mol:	-148.8
Dipole, Da:	5.45
IP(EA), eV:	-9.65(-1.46)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-(3-cyclopentyl-1,2,4-oxadiazolidin-5-ylidene)-2-methylcyclohexa-2,4-dien-1-one

Drug info:

PubChemData

Smile

CCCNC(=O)CCNC(=O)C1=C(C=CS1)C=CC(=O)O

DOS

IR

Vibrations