Geometry & MOs

Info

ID:	288699
PubChem CID:	104324028
Reduced:	FON4C11H15 (1)
Stoich.:	ABC4D11E15 (1)
Weight, g/mol:	262.179361
ΔH_f, kcal/mol:	-61.36
Dipole, Da:	1.83
IP(EA), eV:	-9.01(-0.37)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[2-(propylamino)pyrimidin-4-yl]-3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrol-4-ol

Drug info:

PubChemData

Smile

C1CC(C2C1CN(C2)C3=NC(=NC=C3F)N)O

DOS

IR

Vibrations