Geometry & MOs

Info

ID:	128721
PubChem CID:	51055651
Reduced:	ClON3C17H22 (1)
Stoich.:	ABC3D17E22 (1)
Weight, g/mol:	320.129156
ΔH_f, kcal/mol:	-43.69
Dipole, Da:	2.81
IP(EA), eV:	-8.66(-0.21)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

7-chloro-2-cyclohexyl-3a-hydroxy-8b-methyl-1,4-dihydropyrrolo[3,4-b]indol-3-one

Drug info:

PubChemData

Smile

CC12CN(C(=O)C1(NC3=C2C=C(C=C3)Cl)N)C4CCCCC4

DOS

IR

Vibrations