Geometry & MOs

Info

ID:	336645
PubChem CID:	127255652
Reduced:	N2O4C15H18 (1)
Stoich.:	A2B4C15D18 (1)
Weight, g/mol:	262.10842
ΔH_f, kcal/mol:	-155.74
Dipole, Da:	5.1
IP(EA), eV:	-9.6(-1.62)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl 3-[(1R)-1-amino-2-hydroxyethyl]pyrrole-1-carboxylate;hydrochloride

Drug info:

PubChemData

Smile

CC(C)(C)OC(=O)[C@H](CN1C(=O)C2=CC=CC=C2C1=O)N

DOS

IR

Vibrations