Geometry & MOs

Info

ID:	260903
PubChem CID:	103209017
Reduced:	NF2O3C11H19 (1)
Stoich.:	AB2C3D11E19 (1)
Weight, g/mol:	237.11765
ΔH_f, kcal/mol:	-253.9
Dipole, Da:	4.02
IP(EA), eV:	-9.62(0.78)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(2,2-difluoroethoxy)-1-[2-(hydroxymethyl)pyrrolidin-1-yl]propan-1-one

Drug info:

PubChemData

Smile

C1CN(CCC1CO)C(=O)CCOCC(F)F

DOS

IR

Vibrations