Geometry & MOs

Info

ID:	50736
PubChem CID:	12013321
Reduced:	O3C8H14 (1)
Stoich.:	A3B8C14 (1)
Weight, g/mol:	184.109944
ΔH_f, kcal/mol:	-138.13
Dipole, Da:	3.71
IP(EA), eV:	-10.62(-0.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl (E)-3-[(2S,3R)-3-propyloxiran-2-yl]prop-2-enoate

Drug info:

PubChemData

Smile

C[C@@H](C(C)/C=C/C(=O)OC)O

DOS

IR

Vibrations