Geometry & MOs

Info

ID:	424420
PubChem CID:	135122627
Reduced:	OCl2N4C12H16 (1)
Stoich.:	AB2C4D12E16 (1)
Weight, g/mol:	450.122555
ΔH_f, kcal/mol:	-22.17
Dipole, Da:	6.18
IP(EA), eV:	-8.85(-0.58)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3-hydrazinyl-2,2-dimethylpropyl) benzoate;2,2,2-trifluoroacetic acid

Drug info:

PubChemData

Smile

CN(C)C(=O)C1CCN(CC1)C2=NC=C(C(=N2)Cl)Cl

DOS

IR

Vibrations