Geometry & MOs

Info

ID:	246305
PubChem CID:	103059114
Reduced:	ON2F3C12H21 (1)
Stoich.:	AB2C3D12E21 (1)
Weight, g/mol:	326.9774
ΔH_f, kcal/mol:	-193.46
Dipole, Da:	1.36
IP(EA), eV:	-9.15(1.43)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-[(5-bromo-2-chlorophenoxy)methyl]-N-methylpyrazin-2-amine

Drug info:

PubChemData

Smile

CNC1CCOCC1CN(CC(F)(F)F)C2CC2

DOS

IR

Vibrations