Geometry & MOs

Info

ID:	353547
PubChem CID:	127285124
Reduced:	SN3O3C15H27 (1)
Stoich.:	AB3C3D15E27 (1)
Weight, g/mol:	347.19574
ΔH_f, kcal/mol:	-146.6
Dipole, Da:	2.83
IP(EA), eV:	-8.88(-0.23)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(5-methyl-7-oxo-1H-pyrazolo[1,5-a]pyrimidin-6-yl)-N-(3-morpholin-4-ylbutan-2-yl)acetamide

Drug info:

PubChemData

Smile

CCC(=O)N1CSCC1C(=O)NC(C)C(C)N2CCOCC2

DOS

IR

Vibrations