Geometry & MOs

Info

ID:	341313
PubChem CID:	127264006
Reduced:	FN3H8C12 (1)
Stoich.:	AB3C8D12 (1)
Weight, g/mol:	170.02469
ΔH_f, kcal/mol:	40.9
Dipole, Da:	8.89
IP(EA), eV:	-9.04(-1.0)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-chloro-6-cyclopropyloxypyrimidine

Drug info:

PubChemData

Smile

C1=CC(=C(C=C1N)F)C2=CN=C(C=C2)C#N

DOS

IR

Vibrations