Geometry & MOs

Info

ID:	321843
PubChem CID:	126667068
Reduced:	OS2F3N5C15H16 (1)
Stoich.:	AB2C3D5E15F16 (1)
Weight, g/mol:	286.120509
ΔH_f, kcal/mol:	-106.07
Dipole, Da:	3.95
IP(EA), eV:	-8.67(-0.94)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(2E,3Z)-2-ethylidenehexa-3,5-dienoyl] (2E,4Z)-2-ethenylhepta-2,4,6-trieneperoxoate

Drug info:

PubChemData

Smile

CC1=C(SC(=N1)C)C2=CSC(=N2)NC(=O)CN(/C=C(\C)/C(F)(F)F)N=C

DOS

IR

Vibrations