Geometry & MOs

Info

ID:	331379
PubChem CID:	127248786
Reduced:	FON6C20H21 (1)
Stoich.:	ABC6D20E21 (1)
Weight, g/mol:	380.176087
ΔH_f, kcal/mol:	28.47
Dipole, Da:	3.16
IP(EA), eV:	-8.68(-0.27)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-(3-fluorophenyl)-N,N-dimethyl-4-(4-pyrimidin-2-ylmorpholin-2-yl)pyrimidin-2-amine

Drug info:

PubChemData

Smile

CN(C)C1=NC=C(C(=N1)C2CN(CCO2)C3=NC=CC=N3)C4=CC=C(C=C4)F

DOS

IR

Vibrations