Geometry & MOs

Info

ID:	331458
PubChem CID:	127248865
Reduced:	FO2N5C25H28 (1)
Stoich.:	AB2C5D25E28 (1)
Weight, g/mol:	420.227374
ΔH_f, kcal/mol:	-44.63
Dipole, Da:	5.13
IP(EA), eV:	-8.85(-0.25)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[4-[(2-methoxy-4-methylphenyl)methyl]morpholin-2-yl]-N,N-dimethyl-5-pyrimidin-5-ylpyrimidin-2-amine

Drug info:

PubChemData

Smile

CN(C)C1=NC=C(C(=N1)C2CN(CCO2)C(=O)CCCC3=CC=CC=N3)C4=CC=C(C=C4)F

DOS

IR

Vibrations