Geometry & MOs

Info

ID:	303987
PubChem CID:	124491144
Reduced:	O3N4C14H26 (1)
Stoich.:	A3B4C14D26 (1)
Weight, g/mol:	346.200491
ΔH_f, kcal/mol:	-111.67
Dipole, Da:	3.88
IP(EA), eV:	-9.27(-0.32)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl 4-[(1S)-2-azido-1-hydroxy-1-phenylethyl]piperidine-1-carboxylate

Drug info:

PubChemData

Smile

CC[C@](CN=[N+]=[N-])(C1CCN(CC1)C(=O)OC(C)(C)C)O

DOS

IR

Vibrations