Geometry & MOs

Info

ID:	257568
PubChem CID:	103147158
Reduced:	F2O2N3C12H19 (1)
Stoich.:	A2B2C3D12E19 (1)
Weight, g/mol:	220.091101
ΔH_f, kcal/mol:	-161.55
Dipole, Da:	2.03
IP(EA), eV:	-9.97(0.07)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(2,2-difluoroethoxy)-1-(3,4-dihydro-2H-pyran-5-yl)propan-1-one

Drug info:

PubChemData

Smile

CC(C)CN1C(=NC=N1)CC(=O)CCOCC(F)F

DOS

IR

Vibrations