Geometry & MOs

Info

ID:	138000
PubChem CID:	52297728
Reduced:	NO2C11H14 (2)
Stoich.:	AB2C11D14 (2)
Weight, g/mol:	344.075012
ΔH_f, kcal/mol:	-136.72
Dipole, Da:	4.84
IP(EA), eV:	-9.05(-0.3)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-chloro-N,2-dimethyl-N-[(1R)-1-thiophen-2-ylethyl]quinoline-3-carboxamide

Drug info:

PubChemData

Smile

CC[C@@H](C1=CC=CC=C1)C(=O)NCC2=CC(=C(C=C2)OCC(=O)NCC)OC

DOS

IR

Vibrations