Geometry & MOs

Info

ID:	152997
PubChem CID:	56312105
Reduced:	SN3O4C22H27 (1)
Stoich.:	AB3C4D22E27 (1)
Weight, g/mol:	411.161663
ΔH_f, kcal/mol:	-89.35
Dipole, Da:	5.58
IP(EA), eV:	-7.83(-1.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[[1-(2-methoxyphenyl)pyrrolidin-3-yl]methyl]-3-methylquinoline-8-sulfonamide

Drug info:

PubChemData

Smile

COC1=CC=CC=C1N2CCC(C2)CNS(=O)(=O)C3=CC=CC(=C3)C(=O)NCC=C

DOS

IR

Vibrations