Geometry & MOs

Info

ID:	287441
PubChem CID:	104242355
Reduced:	ON3C13H23 (1)
Stoich.:	AB3C13D23 (1)
Weight, g/mol:	318.01862
ΔH_f, kcal/mol:	-40.27
Dipole, Da:	6.02
IP(EA), eV:	-9.81(0.44)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-bromo-3-(3-chloro-3-cyclopentylpropyl)-5-fluorobenzene

Drug info:

PubChemData

Smile

CC(C)N1C(=NC=N1)CCC(C2CCCC2)O

DOS

IR

Vibrations