Geometry & MOs

Info

ID:	331970
PubChem CID:	127250256
Reduced:	FO2N4C26H29 (1)
Stoich.:	AB2C4D26E29 (1)
Weight, g/mol:	395.199762
ΔH_f, kcal/mol:	-55.38
Dipole, Da:	2.32
IP(EA), eV:	-8.97(-0.29)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(5-benzylpyridin-2-yl)-4-(quinolin-5-ylmethyl)morpholine

Drug info:

PubChemData

Smile

C1CCC2=C(C1)C=NN2CCC(=O)N3CCOC(C3)C4=NC=C(C=C4)CC5=CC=CC=C5F

DOS

IR

Vibrations