Geometry & MOs

Info

ID:

148783

PubChem CID:

53788452

Reduced:

N3O3C37H43 (1)

Stoich.:

A3B3C37D43 (1)

Weight, g/mol:

400.130857

ΔHf, kcal/mol:

-38.95

Dipole, Da:

6.33

IP(EA), eV:

 -8.31(-0.66)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

1-(3-phenylsulfanylphenyl)prop-2-enyl 3-(2,2-difluoroethenyl)-2,2-dimethylcyclopropane-1-carboxylate

Drug info:

PubChemData

Smile

CC1=CC(=CC=C1)C=CC(=O)N(C)C(C(C2=CC=CC=C2)N(C)C)N3CC[C@]45[C@@H]6[C@H]3CC7=C4C(=C(C=C7)O)O[C@H]5CCC6

DOS

IR

Vibrations