Geometry & MOs

Info

ID:	332238
PubChem CID:	127250524
Reduced:	ON5H21C23 (1)
Stoich.:	AB5C21D23 (1)
Weight, g/mol:	371.17461
ΔH_f, kcal/mol:	91.26
Dipole, Da:	5.81
IP(EA), eV:	-8.97(-1.33)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[6-(1H-pyrazol-4-yl)pyridin-2-yl]-4-(quinolin-4-ylmethyl)morpholine

Drug info:

PubChemData

Smile

C1COC(CN1CC2=CC=NC3=CC=CC=C23)C4=CC=CC(=N4)C5=CN=CN=C5

DOS

IR

Vibrations