Geometry & MOs

Info

ID:	37341
PubChem CID:	8019886
Reduced:	NO5C19H19 (1)
Stoich.:	AB5C19D19 (1)
Weight, g/mol:	384.03208
ΔH_f, kcal/mol:	-122.01
Dipole, Da:	6.5
IP(EA), eV:	-8.73(-0.86)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2-[2-[2-(4-bromophenoxy)acetyl]hydrazinyl]-2-oxoethyl] (1R,2R)-2-methylcyclopropane-1-carboxylate

Drug info:

PubChemData

Smile

COC1=CC(=CC(=C1OC)OC)CCC(=O)OC2=CC=C(C=C2)C#N

DOS

IR

Vibrations