Geometry & MOs

Info

ID:	154696
PubChem CID:	56314198
Reduced:	BrN3O3H16C22 (1)
Stoich.:	AB3C3D16E22 (1)
Weight, g/mol:	479.99887
ΔH_f, kcal/mol:	-9.46
Dipole, Da:	4.83
IP(EA), eV:	-9.27(-1.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[3-[(5-bromopyridin-2-yl)carbamoyl]phenyl]-6-chloroquinoline-8-carboxamide

Drug info:

PubChemData

Smile

CC1=CC2=C(C=C1)OC(=C2)C(=O)NC3=CC=CC(=C3)C(=O)NC4=NC=C(C=C4)Br

DOS

IR

Vibrations