Geometry & MOs

Info

ID:	246396
PubChem CID:	103059501
Reduced:	ClFON3C13H13 (1)
Stoich.:	ABCD3E13F13 (1)
Weight, g/mol:	295.088768
ΔH_f, kcal/mol:	-27.58
Dipole, Da:	4.91
IP(EA), eV:	-8.86(-0.47)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-[(3-chloro-2-fluorophenoxy)methyl]-N-propylpyrazin-2-amine

Drug info:

PubChemData

Smile

CCNC1=NC=C(N=C1)COC2=C(C(=CC=C2)Cl)F

DOS

IR

Vibrations