Geometry & MOs

Info

ID:	333061
PubChem CID:	127251485
Reduced:	FO2N4C25H29 (1)
Stoich.:	AB2C4D25E29 (1)
Weight, g/mol:	427.112126
ΔH_f, kcal/mol:	-74.88
Dipole, Da:	3.97
IP(EA), eV:	-9.14(-0.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2-[4-[(2-chlorophenyl)methyl]-6-methylpyridin-2-yl]morpholin-4-yl]-(4-methyl-1,3-thiazol-5-yl)methanone

Drug info:

PubChemData

Smile

CC1=CC(=CC(=N1)C2CN(CCO2)C(=O)CCC3=C(NN=C3C)C)CC4=CC=CC=C4F

DOS

IR

Vibrations