Geometry & MOs

Info

ID:	79913
PubChem CID:	49831295
Reduced:	I2O3H10C11 (1)
Stoich.:	A2B3C10D11 (1)
Weight, g/mol:	358.087291
ΔH_f, kcal/mol:	-86.89
Dipole, Da:	2.06
IP(EA), eV:	-9.33(-1.32)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2-[(4-chloroquinolin-2-yl)amino]phenyl]-phenylmethanone

Drug info:

PubChemData

Smile

CC1(CC(=O)C2=CC(=C(C(=C2O1)I)O)I)C

DOS

IR

Vibrations