Geometry & MOs

Info

ID:	156278
PubChem CID:	56369928
Reduced:	N2O3C24H30 (1)
Stoich.:	A2B3C24D30 (1)
Weight, g/mol:	411.117211
ΔH_f, kcal/mol:	-106.06
Dipole, Da:	7.26
IP(EA), eV:	-8.92(-0.07)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-chloro-N-[2-methyl-4-(thiomorpholin-4-ylmethyl)phenyl]quinoline-6-carboxamide

Drug info:

PubChemData

Smile

CCN(CC)C(=O)C1CCN(CC1)C(=O)C2=C(C=CC(=C2)CC3=CC=CC=C3)O

DOS

IR

Vibrations