Geometry & MOs

Info

ID:	51398
PubChem CID:	12014057
Reduced:	O2H8C9 (2)
Stoich.:	A2B8C9 (2)
Weight, g/mol:	314.220557
ΔH_f, kcal/mol:	-112.85
Dipole, Da:	5.18
IP(EA), eV:	-9.81(-0.48)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl (3S,4R)-4-methyl-3-[(2-methylpropan-2-yl)oxycarbonylamino]piperidine-1-carboxylate

Drug info:

PubChemData

Smile

C1C(C1(C2=CC=CC=C2)C3=CC=CC=C3)(CC(=O)O)C(=O)O

DOS

IR

Vibrations