Geometry & MOs

Info

ID:	24713
PubChem CID:	612540
Reduced:	FON2C14H15 (1)
Stoich.:	ABC2D14E15 (1)
Weight, g/mol:	246.116841
ΔH_f, kcal/mol:	-33.55
Dipole, Da:	1.96
IP(EA), eV:	-8.82(-0.84)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(3-fluoro-4-methoxyphenyl)-5-propylpyrimidine

Drug info:

PubChemData

Smile

CCCC1=CN=C(N=C1)C2=CC(=C(C=C2)OC)F

DOS

IR

Vibrations