Geometry & MOs

Info

ID:	130557
PubChem CID:	51091219
Reduced:	NS2O6C13H19 (1)
Stoich.:	AB2C6D13E19 (1)
Weight, g/mol:	348.204907
ΔH_f, kcal/mol:	-235.3
Dipole, Da:	5.93
IP(EA), eV:	-10.0(-1.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl 4-[[3-(methoxymethyl)benzoyl]amino]piperidine-1-carboxylate

Drug info:

PubChemData

Smile

CCOC(=O)C1=CC=C(C=C1)S(=O)(=O)NCCCS(=O)(=O)C

DOS

IR

Vibrations