Geometry & MOs

Info

ID:	254213
PubChem CID:	103123439
Reduced:	ON4C14H16 (1)
Stoich.:	AB4C14D16 (1)
Weight, g/mol:	269.12766
ΔH_f, kcal/mol:	50.4
Dipole, Da:	5.21
IP(EA), eV:	-8.55(-0.93)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(5-pyrazolo[1,5-a]pyrazin-3-yl-1,3-oxazol-2-yl)ethyl]cyclopropanamine

Drug info:

PubChemData

Smile

CCNCCC1=NC=C(O1)C2=C3C=CC=CN3N=C2

DOS

IR

Vibrations