Geometry & MOs

Info

ID:	419307
PubChem CID:	135107961
Reduced:	FN2O3C18H25 (1)
Stoich.:	AB2C3D18E25 (1)
Weight, g/mol:	260.124881
ΔH_f, kcal/mol:	-157.08
Dipole, Da:	3.99
IP(EA), eV:	-9.01(-0.63)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-methyl-6-[4-(2,2,2-trifluoroethyl)piperazin-1-yl]pyrazine

Drug info:

PubChemData

Smile

CN1CCC[C@]2([C@H]1CN(CC2)C(=O)C3=C(C=CC(=C3)F)OC)CO

DOS

IR

Vibrations