Geometry & MOs

Info

ID:	197066
PubChem CID:	78917286
Reduced:	BrNO3H14C15 (1)
Stoich.:	ABC3D14E15 (1)
Weight, g/mol:	278.141913
ΔH_f, kcal/mol:	-76.13
Dipole, Da:	8.52
IP(EA), eV:	-9.21(-0.84)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(4-methoxyphenyl)-N-methyl-1-quinolin-8-ylmethanamine

Drug info:

PubChemData

Smile

CC(=O)C1=C(C=CC(=C1)Br)OCCN2C=CC=CC2=O

DOS

IR

Vibrations