Geometry & MOs

Info

ID:	424197
PubChem CID:	135121715
Reduced:	FBr2N2O2H3C6 (1)
Stoich.:	AB2C2D2E3F6 (1)
Weight, g/mol:	161.120449
ΔH_f, kcal/mol:	-29.58
Dipole, Da:	3.49
IP(EA), eV:	-9.63(-1.68)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(E)-hex-4-en-2-yl]pyridine

Drug info:

PubChemData

Smile

C1=C(C(=C(C(=C1Br)F)Br)N)[N+](=O)[O-]

DOS

IR

Vibrations