Geometry & MOs

Info

ID:	324827
PubChem CID:	126678418
Reduced:	NC13H23 (1)
Stoich.:	AB13C23 (1)
Weight, g/mol:	411.170668
ΔH_f, kcal/mol:	-11.37
Dipole, Da:	1.11
IP(EA), eV:	-8.21(2.8)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-(3,4-dimethoxyphenyl)-N-(2-fluoropyridin-4-yl)-2-morpholin-4-ylpyrimidin-4-amine

Drug info:

PubChemData

Smile

CC(C)N1CC2CC3CC3(CC1C2)C

DOS

IR

Vibrations