Geometry & MOs

Info

ID:	324149
PubChem CID:	126677031
Reduced:	ON6C20H22 (1)
Stoich.:	AB6C20D22 (1)
Weight, g/mol:	412.081984
ΔH_f, kcal/mol:	56.92
Dipole, Da:	3.56
IP(EA), eV:	-8.21(-0.53)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(2E,4Z)-3,4-difluoro-2-(fluoromethyl)-5-(methoxymethyl)hepta-2,4,6-trienyl] 3-(2,2-dichloroethenyl)-2,2-dimethylcyclopropane-1-carboxylate

Drug info:

PubChemData

Smile

COC1=CC2=C(C=CC=C2N=C/C(=C\N)/CC3=CC(=NC(=C3N)N)N)C=C1

DOS

IR

Vibrations