Geometry & MOs

Info

ID:	246099
PubChem CID:	103044288
Reduced:	ClFON2C15H18 (1)
Stoich.:	ABCD2E15F18 (1)
Weight, g/mol:	280.121178
ΔH_f, kcal/mol:	-58.25
Dipole, Da:	4.39
IP(EA), eV:	-8.97(-0.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-methoxy-5-(quinolin-5-yloxymethyl)aniline

Drug info:

PubChemData

Smile

CC1=C(OC(=C1C(CC2=CC(=C(C=C2)F)Cl)NN)C)C

DOS

IR

Vibrations