Geometry & MOs

Info

ID:	332310
PubChem CID:	127250596
Reduced:	ON2H12C13 (2)
Stoich.:	AB2C12D13 (2)
Weight, g/mol:	383.17461
ΔH_f, kcal/mol:	24.75
Dipole, Da:	5.36
IP(EA), eV:	-9.08(-0.8)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(6-pyrimidin-5-ylpyridin-2-yl)-4-(quinolin-5-ylmethyl)morpholine

Drug info:

PubChemData

Smile

C1COC(CN1CC2=C3C=CC=NC3=CC=C2)C4=CC=CC(=N4)C5=CC=C(C=C5)C(=O)N

DOS

IR

Vibrations