Geometry & MOs

Info

ID:	333043
PubChem CID:	127251467
Reduced:	ON2C12H15 (2)
Stoich.:	AB2C12D15 (2)
Weight, g/mol:	410.187339
ΔH_f, kcal/mol:	-8.64
Dipole, Da:	2.63
IP(EA), eV:	-8.9(0.05)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC1=CC(=CC(=N1)C2CN(CCO2)CC3=CN(N=C3C)C)CC4=CC(=CC=C4)OC

DOS

IR

Vibrations