Geometry & MOs

Info

ID:	250486
PubChem CID:	103097033
Reduced:	N2F3O4C11H11 (1)
Stoich.:	A2B3C4D11E11 (1)
Weight, g/mol:	307.089911
ΔH_f, kcal/mol:	-212.15
Dipole, Da:	6.05
IP(EA), eV:	-10.63(-1.9)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-chloro-N-[2-(2,2-difluoroethoxy)ethyl]-2-propan-2-ylpyrimidine-4-carboxamide

Drug info:

PubChemData

Smile

C1=CC(=C(C=C1C(=O)NCCOCC(F)F)F)[N+](=O)[O-]

DOS

IR

Vibrations