Geometry & MOs

Info

ID:	246320
PubChem CID:	103059191
Reduced:	ClON3C13H14 (1)
Stoich.:	ABC3D13E14 (1)
Weight, g/mol:	291.11384
ΔH_f, kcal/mol:	18.88
Dipole, Da:	3.06
IP(EA), eV:	-8.84(-0.37)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-[(4-chlorophenyl)methoxymethyl]-N-propylpyrazin-2-amine

Drug info:

PubChemData

Smile

CNC1=NC=C(N=C1)COCC2=CC(=CC=C2)Cl

DOS

IR

Vibrations