Geometry & MOs

Info

ID:	306275
PubChem CID:	125003480
Reduced:	O3N4C26H26 (1)
Stoich.:	A3B4C26D26 (1)
Weight, g/mol:	310.117824
ΔH_f, kcal/mol:	-9.56
Dipole, Da:	4.89
IP(EA), eV:	-9.44(-0.96)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(2S)-2-pyrazin-2-ylmorpholin-4-yl]-pyrazolo[1,5-a]pyrimidin-3-ylmethanone

Drug info:

PubChemData

Smile

C1COC[C@H](CN1C(=O)C(C2=CC=CC=C2)(C3=CC=CC=C3)O)CC4=CN5C=CN=C5C=N4

DOS

IR

Vibrations