Geometry & MOs

Info

ID:	331878
PubChem CID:	127250164
Reduced:	FON4C22H23 (1)
Stoich.:	ABC4D22E23 (1)
Weight, g/mol:	388.189926
ΔH_f, kcal/mol:	-12.34
Dipole, Da:	2.94
IP(EA), eV:	-8.77(-0.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2-[5-[(4-methylphenyl)methyl]pyridin-2-yl]morpholin-4-yl]-(5-methylpyrazin-2-yl)methanone

Drug info:

PubChemData

Smile

CC1=CC(=NC(=N1)N2CCOC(C2)C3=NC=C(C=C3)CC4=CC=C(C=C4)F)C

DOS

IR

Vibrations