Geometry & MOs

Info

ID:	43174
PubChem CID:	10319048
Reduced:	OSN6H20C21 (1)
Stoich.:	ABC6D20E21 (1)
Weight, g/mol:	404.268845
ΔH_f, kcal/mol:	75.97
Dipole, Da:	10.5
IP(EA), eV:	-8.94(-0.86)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-cyclopentyl-3-[2-(cyclopentylamino)pyrimidin-4-yl]-2-propan-2-ylpyrazolo[1,5-a]pyridin-7-amine

Drug info:

PubChemData

Smile

C1CC(N(C1)C2=NC(=O)N=C(N2)NC3=CC4=C(C=C3)N=CS4)CC5=CC=CC=C5

DOS

IR

Vibrations