Geometry & MOs

Info

ID:	341359
PubChem CID:	127264052
Reduced:	NOC9H13 (2)
Stoich.:	ABC9D13 (2)
Weight, g/mol:	338.176106
ΔH_f, kcal/mol:	-91.05
Dipole, Da:	4.43
IP(EA), eV:	-9.32(0.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

benzyl (2S,4S)-4-amino-2-methyl-8-azaspiro[4.5]decane-8-carboxylate;hydrochloride

Drug info:

PubChemData

Smile

C[C@H]1C[C@@H](C2(C1)CCN(CC2)C(=O)OCC3=CC=CC=C3)N

DOS

IR

Vibrations