Geometry & MOs

Info

ID:	258166
PubChem CID:	103151579
Reduced:	BrOF3N4C9H14 (1)
Stoich.:	ABC3D4E9F14 (1)
Weight, g/mol:	314.080903
ΔH_f, kcal/mol:	-158.51
Dipole, Da:	4.72
IP(EA), eV:	-8.22(0.23)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[1-(2-chloro-6-fluorophenyl)-4-(2,2,2-trifluoroethoxy)butan-2-yl]hydrazine

Drug info:

PubChemData

Smile

CN1C(=C(C=N1)Br)C(CCOCC(F)(F)F)NN

DOS

IR

Vibrations