Geometry & MOs

Info

ID:	163471
PubChem CID:	57996989
Reduced:	OF6C36H46 (1)
Stoich.:	AB6C36D46 (1)
Weight, g/mol:	311.188529
ΔH_f, kcal/mol:	-379.68
Dipole, Da:	5.32
IP(EA), eV:	-9.26(-0.55)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-cyclopropyl-3-(4-cyclopropyl-2-ethyl-6-methylphenyl)-4-hydroxy-5-methyl-1H-pyrrol-2-one

Drug info:

PubChemData

Smile

CCCCCC1=CC(=C(C=C1)C2CCC(CC2)C3CCC(CC3)C(OC4CCC(CC4)C5=CC(=C(C(=C5)F)F)F)(F)F)F

DOS

IR

Vibrations