Geometry & MOs

Info

ID:	306123
PubChem CID:	125001688
Reduced:	FO2N5C21H22 (1)
Stoich.:	AB2C5D21E22 (1)
Weight, g/mol:	395.175753
ΔH_f, kcal/mol:	-42.94
Dipole, Da:	5.3
IP(EA), eV:	-9.51(-1.45)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

7-[(2R)-1-[2-(4-fluorophenyl)acetyl]piperidin-2-yl]-N-methylpyrazolo[1,5-a]pyrimidine-3-carboxamide

Drug info:

PubChemData

Smile

CNC(=O)C1=C2N=CC=C(N2N=C1)[C@@H]3CCCCN3C(=O)CC4=CC=C(C=C4)F

DOS

IR

Vibrations