Geometry & MOs

Info

ID:	430170
PubChem CID:	135170233
Reduced:	ClSN2O2F3C16H16 (1)
Stoich.:	ABC2D2E3F16G16 (1)
Weight, g/mol:	296.225249
ΔH_f, kcal/mol:	-182.18
Dipole, Da:	4.94
IP(EA), eV:	-9.37(-1.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-ethyl-N-[(8-ethyl-4-methyl-2,3-dihydro-1H-cyclopenta[c]quinolin-7-yl)methyl]ethanamine

Drug info:

PubChemData

Smile

CC#CC1[C@@H]2CNC[C@@H]2CN1S(=O)(=O)C3=C(C(=CC=C3)Cl)C(F)(F)F

DOS

IR

Vibrations