Geometry & MOs

Info

ID:	387415
PubChem CID:	134985291
Reduced:	BrNC5O5H8 (1)
Stoich.:	ABC5D5E8 (1)
Weight, g/mol:	224.916254
ΔH_f, kcal/mol:	-145.86
Dipole, Da:	2.7
IP(EA), eV:	-11.34(-1.97)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1,1,2-trichloro-2-fluoro-2-methoxy-1-nitroethane

Drug info:

PubChemData

Smile

CCOC(=O)C(CO)([N+](=O)[O-])Br

DOS

IR

Vibrations