Geometry & MOs

Info

ID:	207938
PubChem CID:	80472644
Reduced:	SN3C13H19 (1)
Stoich.:	AB3C13D19 (1)
Weight, g/mol:	235.120843
ΔH_f, kcal/mol:	73.99
Dipole, Da:	2.29
IP(EA), eV:	-9.18(-0.77)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 2-(3-bicyclo[3.1.0]hexanyl)-4-methyl-1,3-oxazole-5-carboxylate

Drug info:

PubChemData

Smile

C1CC1NCCC2=NN=C(S2)C3CC4CC4C3

DOS

IR

Vibrations