Geometry & MOs

Info

ID:	429535
PubChem CID:	135169584
Reduced:	N3C9H9F10 (1)
Stoich.:	A3B9C9D10 (1)
Weight, g/mol:	351.118159
ΔH_f, kcal/mol:	-488.22
Dipole, Da:	1.81
IP(EA), eV:	-9.89(-1.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[(E)-2,3,3,3-tetrafluoro-1-[4-(trifluoromethyl)piperazin-1-yl]prop-1-enyl]morpholine

Drug info:

PubChemData

Smile

C1CN(CCN1/C(=C\F)/N(C(F)(F)F)C(F)(F)F)C(F)(F)F

DOS

IR

Vibrations