Geometry & MOs

Info

ID:	250823
PubChem CID:	103099321
Reduced:	BrSO2N4C6H7 (1)
Stoich.:	ABC2D4E6F7 (1)
Weight, g/mol:	192.071034
ΔH_f, kcal/mol:	65.99
Dipole, Da:	7.84
IP(EA), eV:	-9.33(-1.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-cyano-N-[2-(2,2-difluoroethoxy)ethyl]acetamide

Drug info:

PubChemData

Smile

C=C(CN1C(=NC(=N1)[N+](=O)[O-])Br)CS

DOS

IR

Vibrations