Geometry & MOs

Info

ID:	348485
PubChem CID:	127273596
Reduced:	SO3N4C14H20 (1)
Stoich.:	AB3C4D14E20 (1)
Weight, g/mol:	292.153541
ΔH_f, kcal/mol:	-79.44
Dipole, Da:	5.97
IP(EA), eV:	-8.75(-0.03)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(6,7-dihydro-5H-pyrazolo[1,5-a]pyrimidin-4-yl)-4-morpholin-4-ylbutane-1,4-dione

Drug info:

PubChemData

Smile

C1CN(C2=CC=NN2C1)C(=O)CSCC(=O)N3CCOCC3

DOS

IR

Vibrations