Geometry & MOs

Info

ID:	387655
PubChem CID:	134986322
Reduced:	NO2F3C13H14 (1)
Stoich.:	AB2C3D13E14 (1)
Weight, g/mol:	204.11503
ΔH_f, kcal/mol:	-180.94
Dipole, Da:	4.62
IP(EA), eV:	-9.11(-0.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-ethyl-2-phenyl-4,7-dioxaspiro[2.4]heptane

Drug info:

PubChemData

Smile

C[C@H](C1=CC=CC=C1)N=C=C(C(F)(F)F)OCOC

DOS

IR

Vibrations