Geometry & MOs

Info

ID:	226815
PubChem CID:	87558475
Reduced:	O3C12H26 (1)
Stoich.:	A3B12C26 (1)
Weight, g/mol:	433.064777
ΔH_f, kcal/mol:	-160.34
Dipole, Da:	3.2
IP(EA), eV:	-9.4(1.09)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1R,3S)-1-[(R)-cyano-(4-fluoro-3-phenoxyphenyl)methyl]-3-(2,2-dichloroethenyl)-2,2-dimethylcyclopropane-1-carboxylic acid

Drug info:

PubChemData

Smile

CC/C=C/CCO.CCC(=C)O.CCO

DOS

IR

Vibrations