Geometry & MOs

Info

ID:	247080
PubChem CID:	103067354
Reduced:	FON2C14H15 (1)
Stoich.:	ABC2D14E15 (1)
Weight, g/mol:	287.0321
ΔH_f, kcal/mol:	-0.21
Dipole, Da:	7.81
IP(EA), eV:	-9.43(-0.68)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(3-bromo-5-fluorophenoxy)methyl]-N-ethylprop-2-en-1-amine

Drug info:

PubChemData

Smile

C=C(CNC1CC1)COC2=CC(=C(C=C2)C#N)F

DOS

IR

Vibrations