Geometry & MOs

Info

ID:	383478
PubChem CID:	134975220
Reduced:	N2O2H10C21 (1)
Stoich.:	A2B2C10D21 (1)
Weight, g/mol:	414.107653
ΔH_f, kcal/mol:	63.39
Dipole, Da:	5.5
IP(EA), eV:	-8.9(-1.92)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(dicyanomethyl)-3-(dicyanomethylidene)-5,13,16,17-tetraoxapentacyclo[8.4.1.14,7.111,14.02,8]heptadecane-9,9-dicarbonitrile

Drug info:

PubChemData

Smile

C1=CC=C2C(=C1)C3=C4C(=C(C(=C3C2=O)C#N)N)C5=CC=CC=C5C4=O

DOS

IR

Vibrations