Geometry & MOs

Info

ID:	280091
PubChem CID:	103846786
Reduced:	SF2N2O3C10H12 (1)
Stoich.:	AB2C2D3E10F12 (1)
Weight, g/mol:	221.164046
ΔH_f, kcal/mol:	-104.27
Dipole, Da:	3.81
IP(EA), eV:	-8.97(-1.6)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(4-ethyl-3-methylpiperazin-1-yl)pyrazin-2-amine

Drug info:

PubChemData

Smile

CC(CNC1=C(C=C(C=C1F)[N+](=O)[O-])F)S(=O)C

DOS

IR

Vibrations