Geometry & MOs

Info

ID:	402449
PubChem CID:	135056008
Reduced:	N2O5C12H22 (1)
Stoich.:	A2B5C12D22 (1)
Weight, g/mol:	392.194737
ΔH_f, kcal/mol:	-225.4
Dipole, Da:	1.21
IP(EA), eV:	-9.85(-0.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl 4-[(2R,4S)-4-nitrooxy-1-oxo-4-phenylbutan-2-yl]piperidine-1-carboxylate

Drug info:

PubChemData

Smile

CCOC(=O)NN(C(C(C)C)C(=O)C)C(=O)OCC

DOS

IR

Vibrations