Geometry & MOs

Info

ID:	217796
PubChem CID:	85088405
Reduced:	O5C24H32 (1)
Stoich.:	A5B24C32 (1)
Weight, g/mol:	400.215078
ΔH_f, kcal/mol:	-189.9
Dipole, Da:	4.83
IP(EA), eV:	-8.27(-0.83)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-methyl-4-pentyl-2-phenyl-4,5,10,10b-tetrahydro-3aH-pyrrolo[3,4-a]carbazole-1,3-dione

Drug info:

PubChemData

Smile

CCCCCOC1=C(C2=C(C=CC=C2C(=C1)C=CC(=O)OCC)CC)OCOC

DOS

IR

Vibrations