Geometry & MOs

Info

ID:	352583
PubChem CID:	127283671
Reduced:	O3N5C18H27 (1)
Stoich.:	A3B5C18D27 (1)
Weight, g/mol:	333.18009
ΔH_f, kcal/mol:	-97.38
Dipole, Da:	2.76
IP(EA), eV:	-8.97(-0.63)
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-(2-morpholin-4-ylpropyl)acetamide

Drug info:

PubChemData

Smile

CC1=C(C(=NC2=C1C(=O)NN2C)C)CC(=O)NCC(C)N3CCOCC3

DOS

IR

Vibrations