Geometry & MOs

Info

ID:	210228
PubChem CID:	80776936
Reduced:	FON5C14H18 (1)
Stoich.:	ABC5D14E18 (1)
Weight, g/mol:	288.175025
ΔH_f, kcal/mol:	-33.4
Dipole, Da:	2.42
IP(EA), eV:	-9.15(-0.13)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-N-[(4-fluorophenyl)methyl]-4-N,6-dimethyl-2-N-propylpyrimidine-2,4-diamine

Drug info:

PubChemData

Smile

CC(C)OC1=NC(=NC(=N1)N(C)CC2=CC=CC=C2F)N

DOS

IR

Vibrations