Geometry & MOs

Info

ID:	333038
PubChem CID:	127251462
Reduced:	F3O3N4H21C22 (1)
Stoich.:	A3B3C4D21E22 (1)
Weight, g/mol:	376.226312
ΔH_f, kcal/mol:	-154.89
Dipole, Da:	3.65
IP(EA), eV:	-9.61(-0.83)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(4-benzyl-6-methylpyridin-2-yl)-4-[(1,3-dimethylpyrazol-4-yl)methyl]morpholine

Drug info:

PubChemData

Smile

CC1=CC(=CC(=N1)C2CN(CCO2)C(=O)C3=NON=C3C)CC4=CC(=CC=C4)C(F)(F)F

DOS

IR

Vibrations