Geometry & MOs

Info

ID:	53485
PubChem CID:	14716319
Reduced:	O2C18H19 (2)
Stoich.:	A2B18C19 (2)
Weight, g/mol:	208.063663
ΔH_f, kcal/mol:	-97.62
Dipole, Da:	6.98
IP(EA), eV:	-8.94(-0.92)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[4-(4-oxocyclohexa-2,5-dien-1-ylidene)cyclohexa-2,5-dien-1-ylidene]cyanamide

Drug info:

PubChemData

Smile

CCCCCCCCOC1=CC=C(C=C1)C2=CC=C(C=C2)C(=O)OC3=CC=C(C=C3)C(=O)C(C)C4=CC=CC=C4

DOS

IR

Vibrations