Geometry & MOs

Info

ID:	158044
PubChem CID:	56459434
Reduced:	SN4O4C22H32 (1)
Stoich.:	AB4C4D22E32 (1)
Weight, g/mol:	447.230411
ΔH_f, kcal/mol:	-151.8
Dipole, Da:	7.15
IP(EA), eV:	-9.05(-0.95)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N,N,1-trimethyl-2-[3-oxo-3-(4-pyrrolidin-1-ylpiperidin-1-yl)propyl]benzimidazole-5-sulfonamide

Drug info:

PubChemData

Smile

CC(=O)N1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)C(=O)N3CCC(CC3)N4CCCC4

DOS

IR

Vibrations