Geometry & MOs

Info

ID:	330330
PubChem CID:	127247317
Reduced:	ON3C19H23 (1)
Stoich.:	AB3C19D23 (1)
Weight, g/mol:	310.154209
ΔH_f, kcal/mol:	23.67
Dipole, Da:	3.49
IP(EA), eV:	-9.33(-0.05)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2-(4-methyl-1H-pyrazol-5-yl)piperidin-1-yl]-pyrazolo[1,5-a]pyrimidin-3-ylmethanone

Drug info:

PubChemData

Smile

CC1=C(NN=C1)C2CCCCN2C(=O)C3(CC3)C4=CC=CC=C4

DOS

IR

Vibrations