Geometry & MOs

Info

ID:	257564
PubChem CID:	103147096
Reduced:	F2O2C13H22 (1)
Stoich.:	A2B2C13D22 (1)
Weight, g/mol:	246.117984
ΔH_f, kcal/mol:	-219.58
Dipole, Da:	4.34
IP(EA), eV:	-9.76(0.7)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(2,2-difluoroethoxy)-5-(1-methylimidazol-2-yl)pentan-3-one

Drug info:

PubChemData

Smile

CCC1CCC(CC1)C(=O)CCOCC(F)F

DOS

IR

Vibrations