Geometry & MOs

Info

ID:	331465
PubChem CID:	127248872
Reduced:	FON6C24H31 (1)
Stoich.:	ABC6D24E31 (1)
Weight, g/mol:	420.227374
ΔH_f, kcal/mol:	-2.87
Dipole, Da:	1.25
IP(EA), eV:	-8.67(-0.43)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[4-[(2-methoxy-3-methylphenyl)methyl]morpholin-2-yl]-N,N-dimethyl-5-pyrimidin-5-ylpyrimidin-2-amine

Drug info:

PubChemData

Smile

CC(C)(C)C1=C(C=NN1)CN2CCOC(C2)C3=NC(=NC=C3C4=CC=C(C=C4)F)N(C)C

DOS

IR

Vibrations