Geometry & MOs

Info

ID:	352974
PubChem CID:	127284065
Reduced:	O2N5C22H33 (1)
Stoich.:	A2B5C22D33 (1)
Weight, g/mol:	317.185175
ΔH_f, kcal/mol:	-54.02
Dipole, Da:	7.15
IP(EA), eV:	-8.79(-0.95)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(1-ethylpiperidin-3-yl)-2-(5-methyl-7-oxo-1H-pyrazolo[1,5-a]pyrimidin-6-yl)acetamide

Drug info:

PubChemData

Smile

CC1=C(C(=NC2=CC(=O)NN12)C)CC(=O)N3CCCN(CC3)CC4CCCCC4

DOS

IR

Vibrations