Geometry & MOs

Info

ID:	48873
PubChem CID:	11528424
Reduced:	OC2H3 (4)
Stoich.:	AB2C3 (4)
Weight, g/mol:	172.109944
ΔH_f, kcal/mol:	-195.16
Dipole, Da:	4.56
IP(EA), eV:	-10.71(0.57)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl (2R,3R)-3-(2-methylpropyl)oxirane-2-carboxylate

Drug info:

PubChemData

Smile

C[C@]12CCC(O[C@H]1CC(=O)O2)O

DOS

IR

Vibrations