Geometry & MOs

Info

ID:	254242
PubChem CID:	103123649
Reduced:	ON4C11H16 (1)
Stoich.:	AB4C11D16 (1)
Weight, g/mol:	255.11201
ΔH_f, kcal/mol:	28.54
Dipole, Da:	6.39
IP(EA), eV:	-8.56(-0.37)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(5-pyrazolo[1,5-a]pyrazin-3-yl-1,3-oxazol-4-yl)methyl]cyclopropanamine

Drug info:

PubChemData

Smile

CC(C)NCC1=C(OC=N1)C2=NN(C=C2)C

DOS

IR

Vibrations