Geometry & MOs

Info

ID:	254710
PubChem CID:	103127104
Reduced:	ON3C13H13 (1)
Stoich.:	AB3C13D13 (1)
Weight, g/mol:	274.179361
ΔH_f, kcal/mol:	52.91
Dipole, Da:	2.84
IP(EA), eV:	-8.66(-0.25)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[oxan-4-yl(pyrazolo[1,5-a]pyrazin-3-yl)methyl]propan-1-amine

Drug info:

PubChemData

Smile

CN1C2=CC=CC=C2C(=N1)C(C3=CC=CO3)N

DOS

IR

Vibrations