Geometry & MOs

Info

ID:	390108
PubChem CID:	134997109
Reduced:	NO4C29H39 (1)
Stoich.:	AB4C29D39 (1)
Weight, g/mol:	225.115364
ΔH_f, kcal/mol:	-157.94
Dipole, Da:	2.73
IP(EA), eV:	-8.98(0.23)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-ethenyl-2-[(E)-4-phenylbut-1-enyl]-1,3-oxazole

Drug info:

PubChemData

Smile

C[C@H](C1=CC=CC=C1)N(CC2=CC=CC=C2)C(CC(=O)OC(C)(C)C)[C@H]3[C@H](OC(O3)(C)C)C=C

DOS

IR

Vibrations