Geometry & MOs

Info

ID:	407786
PubChem CID:	135080541
Reduced:	NO3C13H15 (1)
Stoich.:	AB3C13D15 (1)
Weight, g/mol:	171.053158
ΔH_f, kcal/mol:	-96.35
Dipole, Da:	4.32
IP(EA), eV:	-8.81(-0.07)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl (E)-3-[(5R)-2-oxo-1,3-oxazolidin-5-yl]prop-2-enoate

Drug info:

PubChemData

Smile

CN1CCC(=O)C(C2=CC=CC=C21)C(=O)OC

DOS

IR

Vibrations