Geometry & MOs

Info

ID:	436297
PubChem CID:	135198416
Reduced:	FC18H29 (1)
Stoich.:	AB18C29 (1)
Weight, g/mol:	349.104498
ΔH_f, kcal/mol:	-81.14
Dipole, Da:	2.28
IP(EA), eV:	-9.38(1.21)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2R,4S)-N-[3-(2-chlorophenyl)-2-fluorophenyl]-4-fluoro-2-methylcyclopentane-1-carboxamide

Drug info:

PubChemData

Smile

CC1CCC/C(=C\[C@]23CCCCCC2CC3)/[C@H](C1)F

DOS

IR

Vibrations