Geometry & MOs

Info

ID:	17737
PubChem CID:	515953
Reduced:	NOH3C5 (2)
Stoich.:	ABC3D5 (2)
Weight, g/mol:	186.042927
ΔH_f, kcal/mol:	1.16
Dipole, Da:	5.46
IP(EA), eV:	-9.63(-1.84)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-methyl-2,3-dioxoindole-5-carbonitrile

Drug info:

PubChemData

Smile

CN1C2=C(C=C(C=C2)C#N)C(=O)C1=O

DOS

IR

Vibrations