Geometry & MOs

Info

ID:	391187
PubChem CID:	135003432
Reduced:	NOC18H23 (1)
Stoich.:	ABC18D23 (1)
Weight, g/mol:	228.152558
ΔH_f, kcal/mol:	-25.59
Dipole, Da:	5.2
IP(EA), eV:	-8.27(-0.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl 3-cyclohexyl-2-fluoroprop-2-enoate

Drug info:

PubChemData

Smile

CCCC/C=C/C(=C\1/CN(C2=CC=CC=C12)C(=O)C)/C

DOS

IR

Vibrations