Geometry & MOs

Info

ID:	34359
PubChem CID:	7890914
Reduced:	NO3H13C19 (1)
Stoich.:	AB3C13D19 (1)
Weight, g/mol:	395.97794
ΔH_f, kcal/mol:	-38.47
Dipole, Da:	3.44
IP(EA), eV:	-9.05(-1.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2-[2-(2-bromobenzoyl)hydrazinyl]-2-oxoethyl] 2-thiophen-2-ylacetate

Drug info:

PubChemData

Smile

C1=CC=C2C(=C1)C=CC(=C2O)C(=O)OCC3=CC(=CC=C3)C#N

DOS

IR

Vibrations