Geometry & MOs

Info

ID:	6547
PubChem CID:	68847
Reduced:	SO2N4C19H28 (1)
Stoich.:	AB2C4D19E28 (1)
Weight, g/mol:	376.193297
ΔH_f, kcal/mol:	-50.25
Dipole, Da:	3.32
IP(EA), eV:	-8.22(0.07)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(6aR,9S,10aR)-9-(diethylsulfamoylamino)-7-methyl-6,6a,8,9,10,10a-hexahydro-4H-indolo[4,3-fg]quinoline

Drug info:

PubChemData

Smile

CCN(CC)S(=O)(=O)N[C@H]1C[C@H]2[C@@H](CC3=CNC4=CC=CC2=C34)N(C1)C

DOS

IR

Vibrations