Geometry & MOs

Info

ID:	424421
PubChem CID:	135122629
Reduced:	NF3O3C8H10 (2)
Stoich.:	AB3C3D8E10 (2)
Weight, g/mol:	222.136828
ΔH_f, kcal/mol:	-542.85
Dipole, Da:	5.48
IP(EA), eV:	-8.51(-0.91)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3-hydrazinyl-2,2-dimethylpropyl) benzoate

Drug info:

PubChemData

Smile

CC(C)(CNN)COC(=O)C1=CC=CC=C1.C(=O)(C(F)(F)F)O.C(=O)(C(F)(F)F)O

DOS

IR

Vibrations