Geometry & MOs

Info

ID:	332035
PubChem CID:	127250321
Reduced:	FON3H22C25 (1)
Stoich.:	ABC3D22E25 (1)
Weight, g/mol:	411.194677
ΔH_f, kcal/mol:	21.62
Dipole, Da:	4.68
IP(EA), eV:	-8.77(-0.67)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[5-(3-methoxyphenyl)pyridin-2-yl]-4-(quinolin-6-ylmethyl)morpholine

Drug info:

PubChemData

Smile

C1COC(CN1CC2=CC3=C(C=C2)N=CC=C3)C4=NC=C(C=C4)C5=CC=CC=C5F

DOS

IR

Vibrations