Geometry & MOs

Info

ID:	51690
PubChem CID:	12014404
Reduced:	S2O3N4H12C18 (1)
Stoich.:	A2B3C4D12E18 (1)
Weight, g/mol:	564.281701
ΔH_f, kcal/mol:	43.45
Dipole, Da:	5.62
IP(EA), eV:	-9.34(-1.56)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[3-(2,2-diphenylethenyl)-1,5,5-triphenylhexa-1,3-dienyl]benzene

Drug info:

PubChemData

Smile

C1C(=O)N=C(S1)N2C3C(C(=N2)C4=CC=CS4)C(=O)N(C3=O)C5=CC=CC=C5

DOS

IR

Vibrations