Geometry & MOs

Info

ID:	231511
PubChem CID:	87573972
Reduced:	N2O2F3H13C16 (1)
Stoich.:	A2B2C3D13E16 (1)
Weight, g/mol:	322.100363
ΔH_f, kcal/mol:	-191.19
Dipole, Da:	9.21
IP(EA), eV:	-9.09(-1.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(2,2,2-trifluoroethoxy)-2-[4-(2,2,2-trifluoroethoxy)but-1-en-2-yloxy]but-1-ene

Drug info:

PubChemData

Smile

CC1=C(C=CC(=N1)C(F)(F)F)/C(=C/NC2=CC=CC=C2)/C(=O)O

DOS

IR

Vibrations