Geometry & MOs

Info

ID:	247092
PubChem CID:	103067545
Reduced:	BrN2O3C10H11 (1)
Stoich.:	AB2C3D10E11 (1)
Weight, g/mol:	242.141913
ΔH_f, kcal/mol:	1.54
Dipole, Da:	3.05
IP(EA), eV:	-9.61(-1.74)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-ethyl-2-(quinolin-5-yloxymethyl)prop-2-en-1-amine

Drug info:

PubChemData

Smile

C=C(CN)COC1=C(C=CC(=C1)[N+](=O)[O-])Br

DOS

IR

Vibrations