Geometry & MOs

Info

ID:	177472
PubChem CID:	76190790
Reduced:	NO5H23C26 (1)
Stoich.:	AB5C23D26 (1)
Weight, g/mol:	442.189257
ΔH_f, kcal/mol:	-94.8
Dipole, Da:	1.53
IP(EA), eV:	-8.23(-1.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

7-[4-(dimethylamino)phenyl]-1,4-dimethyl-2-[(4-methyl-5-oxo-2H-furan-2-yl)oxymethylidene]-1H-cyclopenta[b]indol-3-one

Drug info:

PubChemData

Smile

CC1C(=COC2C=C(C(=O)O2)C)C(=O)C3=C1C4=C(N3C)C=CC(=C4)C5=CC=C(C=C5)OC

DOS

IR

Vibrations