Geometry & MOs

Info

ID:	341012
PubChem CID:	127263447
Reduced:	SN2O6C15H22 (1)
Stoich.:	AB2C6D15E22 (1)
Weight, g/mol:	328.118985
ΔH_f, kcal/mol:	-258.34
Dipole, Da:	4.78
IP(EA), eV:	-9.25(-0.64)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-O-benzyl 4-O-methyl 4-aminopiperidine-1,4-dicarboxylate;hydrochloride

Drug info:

PubChemData

Smile

CC(C)(C)OC(=O)N(C1=NC(=CS1)C(=O)OC)C(=O)OC(C)(C)C

DOS

IR

Vibrations