Geometry & MOs

Info

ID:	340880
PubChem CID:	127263315
Reduced:	N2O6C20H29 (2)
Stoich.:	A2B6C20D29 (2)
Weight, g/mol:	152.035255
ΔH_f, kcal/mol:	-525.99
Dipole, Da:	7.34
IP(EA), eV:	-8.36(-1.13)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(5S)-5-(aminomethyl)-1,3-oxazolidin-2-one;hydrochloride

Drug info:

PubChemData

Smile

C[C@@H]1CCNCCN1C(=O)OC(C)(C)C.C[C@@H]1CCNCCN1C(=O)OC(C)(C)C.C1=CC=C(C=C1)C(=O)O[C@@H]([C@@H](C(=O)O)OC(=O)C2=CC=CC=C2)C(=O)O

DOS

IR

Vibrations