Geometry & MOs

Info

ID:	429680
PubChem CID:	135169731
Reduced:	N3F4H11C15 (1)
Stoich.:	A3B4C11D15 (1)
Weight, g/mol:	350.12291
ΔH_f, kcal/mol:	-106.81
Dipole, Da:	1.78
IP(EA), eV:	-9.12(-1.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[(E)-1-[3,5-bis(trifluoromethyl)piperidin-1-yl]-2-fluoroethenyl]morpholine

Drug info:

PubChemData

Smile

C=C/C(=C/N)/C(=NC1=C2C=CC=C(C2=CN=C1)F)C(F)(F)F

DOS

IR

Vibrations