Geometry & MOs

Info

ID:	323674
PubChem CID:	126675712
Reduced:	NO4C20H29 (1)
Stoich.:	AB4C20D29 (1)
Weight, g/mol:	307.178358
ΔH_f, kcal/mol:	-201.1
Dipole, Da:	3.32
IP(EA), eV:	-9.49(-0.61)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl (2R)-2-[[3-(hydroxymethyl)phenoxy]methyl]pyrrolidine-1-carboxylate

Drug info:

PubChemData

Smile

CCOC(=O)C1=CC=CC(=C1)C2CCN(C(C2)C)C(=O)OC(C)(C)C

DOS

IR

Vibrations