Geometry & MOs

Info

ID:	395905
PubChem CID:	135026863
Reduced:	NO3C22H25 (1)
Stoich.:	AB3C22D25 (1)
Weight, g/mol:	367.178358
ΔH_f, kcal/mol:	-51.58
Dipole, Da:	2.86
IP(EA), eV:	-9.08(-0.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

benzyl 5-butyl-3-(4-methoxyphenyl)-3H-1,2-oxazole-2-carboxylate

Drug info:

PubChemData

Smile

CCCCC1=CC(N(O1)C(=O)OCC2=CC=CC=C2)C3=CC=C(C=C3)C

DOS

IR

Vibrations