Geometry & MOs

Info

ID:	259521
PubChem CID:	103167320
Reduced:	SN3C12H21 (1)
Stoich.:	AB3C12D21 (1)
Weight, g/mol:	267.147058
ΔH_f, kcal/mol:	27.48
Dipole, Da:	3.18
IP(EA), eV:	-9.16(-0.65)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 2-[(3-ethoxycyclobutyl)methyl]-4-methyl-1,3-oxazole-5-carboxylate

Drug info:

PubChemData

Smile

CCC(C1=NN=C(S1)CC2CCC2)NCC

DOS

IR

Vibrations