Geometry & MOs

Info

ID:	142763
PubChem CID:	53088426
Reduced:	SN4O4C23H34 (1)
Stoich.:	AB4C4D23E34 (1)
Weight, g/mol:	476.245727
ΔH_f, kcal/mol:	-167.07
Dipole, Da:	6.06
IP(EA), eV:	-8.75(-0.62)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-cyclooctyl-2-[3-(dimethylsulfamoyl)-6-oxo-7,8,9,10-tetrahydro-6aH-pyrido[1,2-a]quinoxalin-5-yl]acetamide

Drug info:

PubChemData

Smile

CN(C)S(=O)(=O)C1=CC2=C(C=C1)N3CCCCC3C(=O)N2CC(=O)NC4CCCCCC4

DOS

IR

Vibrations