Geometry & MOs

Info

ID:	372267
PubChem CID:	131295193
Reduced:	N2F3C7H9 (1)
Stoich.:	A2B3C7D9 (1)
Weight, g/mol:	184.14633
ΔH_f, kcal/mol:	-143.93
Dipole, Da:	5.31
IP(EA), eV:	-10.3(0.87)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(3-ethyl-1-methoxycyclohexyl)ethanone

Drug info:

PubChemData

Smile

C1CC(NC1CC(F)(F)F)C#N

DOS

IR

Vibrations