Geometry & MOs

Info

ID:	257590
PubChem CID:	103147261
Reduced:	F2O3C14H16 (1)
Stoich.:	A2B3C14D16 (1)
Weight, g/mol:	276.128549
ΔH_f, kcal/mol:	-184.31
Dipole, Da:	5.01
IP(EA), eV:	-9.42(-0.6)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(2,2-difluoroethoxy)-1-(4-methoxy-2-propylpyrazol-3-yl)propan-1-one

Drug info:

PubChemData

Smile

C1CC1OC2=CC=C(C=C2)C(=O)CCOCC(F)F

DOS

IR

Vibrations