Geometry & MOs

Info

ID:	333072
PubChem CID:	127251496
Reduced:	F3N3O3C22H24 (1)
Stoich.:	A3B3C3D22E24 (1)
Weight, g/mol:	376.226312
ΔH_f, kcal/mol:	-260.27
Dipole, Da:	5.17
IP(EA), eV:	-9.47(-0.77)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[6-methyl-4-[(4-methylphenyl)methyl]pyridin-2-yl]-4-[(1-methylpyrazol-4-yl)methyl]morpholine

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations