Geometry & MOs

Info

ID:	159816
PubChem CID:	57288780
Reduced:	BrFC25H36 (1)
Stoich.:	ABC25D36 (1)
Weight, g/mol:	234.128075
ΔH_f, kcal/mol:	-83.69
Dipole, Da:	3.84
IP(EA), eV:	-9.33(-0.25)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-fluoro-1-methyl-3-piperazin-1-ylindazole

Drug info:

PubChemData

Smile

CCCCCC1CCC(CC1)C2CCC(=C(C)C3=CC(=C(C=C3)Br)F)CC2

DOS

IR

Vibrations