Geometry & MOs

Info

ID:	122124
PubChem CID:	50795755
Reduced:	FN4O4H15C21 (1)
Stoich.:	AB4C4D15E21 (1)
Weight, g/mol:	486.226705
ΔH_f, kcal/mol:	-82.98
Dipole, Da:	3.03
IP(EA), eV:	-8.72(-1.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-[2-(4-benzylpiperidin-1-yl)-2-oxoethyl]-2-(3,4-dimethoxyphenyl)pyrazolo[1,5-a]pyrazin-4-one

Drug info:

PubChemData

Smile

C1OC2=C(O1)C=C(C=C2)C3=NN4C=CN(C(=O)C4=C3)CC(=O)NC5=CC(=CC=C5)F

DOS

IR

Vibrations