Geometry & MOs

Info

ID:	353001
PubChem CID:	127284122
Reduced:	ON4C21H22 (1)
Stoich.:	AB4C21D22 (1)
Weight, g/mol:	331.200825
ΔH_f, kcal/mol:	43.31
Dipole, Da:	8.95
IP(EA), eV:	-9.06(-0.99)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(5-methyl-7-oxo-1H-pyrazolo[1,5-a]pyrimidin-6-yl)-N-(1-propan-2-ylpiperidin-4-yl)acetamide

Drug info:

PubChemData

Smile

C1CC2=CC=CC=C2C1C(=O)N3CCC(CC3)C4=NN=C5N4C=CC=C5

DOS

IR

Vibrations