Geometry & MOs

Info

ID:	204307
PubChem CID:	79944647
Reduced:	N2F3O3C12H17 (1)
Stoich.:	A2B3C3D12E17 (1)
Weight, g/mol:	284.155849
ΔH_f, kcal/mol:	-293.41
Dipole, Da:	4.05
IP(EA), eV:	-9.7(0.28)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(3-methylsulfanylpropyl)-3-propan-2-yl-6,7,8,8a-tetrahydro-3H-pyrrolo[1,2-a]pyrazine-1,4-dione

Drug info:

PubChemData

Smile

C1CC2C(=O)N(CCC(=O)N2C1)CCOCC(F)(F)F

DOS

IR

Vibrations