Geometry & MOs

Info

ID:	280994
PubChem CID:	103852340
Reduced:	NSO3C12H15 (1)
Stoich.:	ABC3D12E15 (1)
Weight, g/mol:	249.136493
ΔH_f, kcal/mol:	-117.3
Dipole, Da:	2.3
IP(EA), eV:	-8.88(-0.6)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2R)-N-benzyl-N-(2-hydroxyethyl)oxolane-2-carboxamide

Drug info:

PubChemData

Smile

CN(C1CCSC1)C(=O)C2=C(C=C(C=C2)O)O

DOS

IR

Vibrations