Geometry & MOs

Info

ID:	429565
PubChem CID:	135169614
Reduced:	ON2F4C13H20 (1)
Stoich.:	AB2C4D13E20 (1)
Weight, g/mol:	246.15437
ΔH_f, kcal/mol:	-239.01
Dipole, Da:	6.6
IP(EA), eV:	-8.79(0.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[1-(azepan-1-yl)-2,2-difluoroethenyl]morpholine

Drug info:

PubChemData

Smile

C1CCCN(CC1)/C(=C(/C(F)(F)F)\F)/N2CCOCC2

DOS

IR

Vibrations