Geometry & MOs

Info

ID:	430111
PubChem CID:	135170172
Reduced:	ClN3C20H26 (1)
Stoich.:	AB3C20D26 (1)
Weight, g/mol:	322.240899
ΔH_f, kcal/mol:	16.78
Dipole, Da:	4.34
IP(EA), eV:	-8.96(-0.71)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

7-[(3,3-dimethylpyrrolidin-1-yl)methyl]-8-ethyl-4-methyl-2,3-dihydro-1H-cyclopenta[c]quinoline

Drug info:

PubChemData

Smile

CCC1=CC2=C(C=C1CN3CCCC3)N=C(C4=C2CCN(C4)C)Cl

DOS

IR

Vibrations