Geometry & MOs

Info

ID:	84773
PubChem CID:	49869786
Reduced:	ON5C28H37 (1)
Stoich.:	AB5C28D37 (1)
Weight, g/mol:	420.151016
ΔH_f, kcal/mol:	3.9
Dipole, Da:	5.81
IP(EA), eV:	-8.43(-0.46)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-[(2R)-2-(2,5-difluorophenyl)pyrrolidin-1-yl]-N-pyridin-2-ylpyrazolo[1,5-a]pyrimidine-3-carboxamide

Drug info:

PubChemData

Smile

CCC1=NC(=C(N1C2=CC=CC=C2)C)C(=O)NCCCN3CCN(CC3)C4=CC=CC(=C4C)C

DOS

IR

Vibrations