Geometry & MOs

Info

ID:	337963
PubChem CID:	127258586
Reduced:	BrNO3C9H14 (1)
Stoich.:	ABC3D9E14 (1)
Weight, g/mol:	208.96876
ΔH_f, kcal/mol:	-138.4
Dipole, Da:	4.49
IP(EA), eV:	-10.01(-0.53)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2Z)-4-bromo-2-methoxyiminobutanoic acid

Drug info:

PubChemData

Smile

CCCC(=O)OC(=O)[C@@H]1CC(CN1)Br

DOS

IR

Vibrations