Geometry & MOs

Info

ID:	333000
PubChem CID:	127251424
Reduced:	N2O2F3C21H23 (1)
Stoich.:	A2B2C3D21E23 (1)
Weight, g/mol:	403.189592
ΔH_f, kcal/mol:	-217.69
Dipole, Da:	6.81
IP(EA), eV:	-9.28(-0.63)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2-[4-[(3-methoxyphenyl)methyl]-6-methylpyridin-2-yl]morpholin-4-yl]-pyridin-2-ylmethanone

Drug info:

PubChemData

Smile

CCC(=O)N1CCOC(C1)C2=NC(=CC(=C2)CC3=CC(=CC=C3)C(F)(F)F)C

DOS

IR

Vibrations