Geometry & MOs

Info

ID:	331877
PubChem CID:	127250163
Reduced:	FON4C22H23 (1)
Stoich.:	ABC4D22E23 (1)
Weight, g/mol:	378.18559
ΔH_f, kcal/mol:	-11.68
Dipole, Da:	0.99
IP(EA), eV:	-8.71(-0.21)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(4,6-dimethylpyrimidin-2-yl)-2-[5-[(4-fluorophenyl)methyl]pyridin-2-yl]morpholine

Drug info:

PubChemData

Smile

CC1=CC(=NC(=N1)N2CCOC(C2)C3=NC=C(C=C3)CC4=CC=CC=C4F)C

DOS

IR

Vibrations