Geometry & MOs

Info

ID:	332996
PubChem CID:	127251420
Reduced:	N2O2F3C22H25 (1)
Stoich.:	A2B2C3D22E25 (1)
Weight, g/mol:	396.221306
ΔH_f, kcal/mol:	-221.7
Dipole, Da:	3.66
IP(EA), eV:	-9.14(-0.69)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

cyclohexyl-[2-[4-[(4-fluorophenyl)methyl]-6-methylpyridin-2-yl]morpholin-4-yl]methanone

Drug info:

PubChemData

Smile

CC1=CC(=CC(=N1)C2CN(CCO2)C(=O)C(C)C)CC3=CC(=CC=C3)C(F)(F)F

DOS

IR

Vibrations