Geometry & MOs

Info

ID:	233127
PubChem CID:	87692438
Reduced:	N2F3O4H23C26 (1)
Stoich.:	A2B3C4D23E26 (1)
Weight, g/mol:	170.057909
ΔH_f, kcal/mol:	-243.1
Dipole, Da:	7.68
IP(EA), eV:	-9.17(-0.88)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(oxiran-2-ylmethoxy)-6,7-dioxatricyclo[3.1.1.01,5]heptane

Drug info:

PubChemData

Smile

CC1CC2=C(CN1C(=O)C(F)(F)F)C=C(C=C2)C(=O)CN3C=CC(=CC3=O)OCC4=CC=CC=C4

DOS

IR

Vibrations