Geometry & MOs

Info

ID:	331863
PubChem CID:	127250149
Reduced:	N2O2F3C20H21 (1)
Stoich.:	A2B2C3D20E21 (1)
Weight, g/mol:	377.153955
ΔH_f, kcal/mol:	-203.77
Dipole, Da:	5.32
IP(EA), eV:	-9.31(-0.58)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2-[5-[(4-fluorophenyl)methyl]pyridin-2-yl]morpholin-4-yl]-pyridin-2-ylmethanone

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations