Geometry & MOs

Info

ID:	257661
PubChem CID:	103147782
Reduced:	F2O3C14H18 (1)
Stoich.:	A2B3C14D18 (1)
Weight, g/mol:	282.094662
ΔH_f, kcal/mol:	-197.25
Dipole, Da:	4.88
IP(EA), eV:	-9.02(0.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(5-chloro-1,3-dimethylpyrazol-4-yl)-4-(2,2-difluoroethoxy)butan-2-ol

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations