Geometry & MOs

Info

ID:	289273
PubChem CID:	104343122
Reduced:	ON4C16H26 (1)
Stoich.:	AB4C16D26 (1)
Weight, g/mol:	262.179361
ΔH_f, kcal/mol:	-32.51
Dipole, Da:	4.94
IP(EA), eV:	-8.57(0.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CCCNC1=CC(=NC(=N1)COC)N2CC3CCCC3C2

DOS

IR

Vibrations