Geometry & MOs

Info

ID:	449447
PubChem CID:	135298675
Reduced:	ON8C30H38 (1)
Stoich.:	AB8C30D38 (1)
Weight, g/mol:	211.099714
ΔH_f, kcal/mol:	86.05
Dipole, Da:	5.21
IP(EA), eV:	-8.8(-0.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-ethenyl-2-phenyl-4-[(Z)-prop-1-enyl]-1,3-oxazole

Drug info:

PubChemData

Smile

CC(C)(C)NC(=O)N1CCC2(C1)CC(C2)N3C(=C(C(=N3)C4=CN(N=C4)CC5=CC(=CC=C5)C6CC6)C#N)NC

DOS

IR

Vibrations