Geometry & MOs

Info

ID:	267961
PubChem CID:	103591291
Reduced:	FO2N3C13H18 (1)
Stoich.:	AB2C3D13E18 (1)
Weight, g/mol:	267.138305
ΔH_f, kcal/mol:	-44.45
Dipole, Da:	7.77
IP(EA), eV:	-8.72(-0.97)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(4-fluoro-5-methyl-2-nitrophenyl)-2,5-dimethylpiperazine

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1F)[N+](=O)[O-])N2CCNC(C2)(C)C

DOS

IR

Vibrations