Geometry & MOs

Info

ID:	333793
PubChem CID:	127252345
Reduced:	O2N3C13H19 (1)
Stoich.:	A2B3C13D19 (1)
Weight, g/mol:	359.19574
ΔH_f, kcal/mol:	-48.4
Dipole, Da:	4.11
IP(EA), eV:	-9.22(-0.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl 2-[6-[(5-methyl-1H-pyrazol-3-yl)amino]pyridin-2-yl]morpholine-4-carboxylate

Drug info:

PubChemData

Smile

CN(C)CC(=O)N1CCOC(C1)C2=CC=CC=N2

DOS

IR

Vibrations