Geometry & MOs

Info

ID:	350135
PubChem CID:	127277213
Reduced:	SO2N3C20H27 (1)
Stoich.:	AB2C3D20E27 (1)
Weight, g/mol:	373.182398
ΔH_f, kcal/mol:	-52.4
Dipole, Da:	7.79
IP(EA), eV:	-8.44(-1.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

8-methyl-5-[2-(piperidin-1-ylmethyl)pyrrolidin-1-yl]sulfonylquinoline

Drug info:

PubChemData

Smile

CC1=CC2=C(C(=CC=C2)S(=O)(=O)N3CCCC3CN4CCCCC4)N=C1

DOS

IR

Vibrations