Geometry & MOs

Info

ID:	370706
PubChem CID:	127339944
Reduced:	OSN5C17H25 (1)
Stoich.:	ABC5D17E25 (1)
Weight, g/mol:	324.169859
ΔH_f, kcal/mol:	3.02
Dipole, Da:	3.07
IP(EA), eV:	-8.32(0.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2,7-dimethylpyrazolo[1,5-a]pyrimidin-6-yl)-[4-(1H-pyrazol-5-yl)piperidin-1-yl]methanone

Drug info:

PubChemData

Smile

CC(C)(C)N1C=CN=C1SCC(=O)N2CCC(CC2)C3=CC=NN3

DOS

IR

Vibrations