Geometry & MOs

Info

ID:	402150
PubChem CID:	135054644
Reduced:	O3C21H34 (1)
Stoich.:	A3B21C34 (1)
Weight, g/mol:	306.157957
ΔH_f, kcal/mol:	-100.77
Dipole, Da:	3.61
IP(EA), eV:	-9.57(0.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 2-(2-benzoylhydrazinyl)-3-ethyl-4-oxopentanoate

Drug info:

PubChemData

Smile

CCCCCCC[C@H](CC(=O)CC)OOC(C)(C)C1=CC=CC=C1

DOS

IR

Vibrations