Geometry & MOs

Info

ID:	247736
PubChem CID:	103073021
Reduced:	ON4C12H16 (1)
Stoich.:	AB4C12D16 (1)
Weight, g/mol:	274.179361
ΔH_f, kcal/mol:	31.01
Dipole, Da:	3.68
IP(EA), eV:	-8.94(-0.64)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-[2-[(tert-butylamino)methyl]prop-2-enyl]-2-methylpyrazolo[1,5-a]pyrazin-4-one

Drug info:

PubChemData

Smile

CCNCC(=C)CN1C=CN2C(=CC=N2)C1=O

DOS

IR

Vibrations