Geometry & MOs

Info

ID:	379958
PubChem CID:	134964400
Reduced:	NOF5H26C31 (1)
Stoich.:	ABC5D26E31 (1)
Weight, g/mol:	262.131742
ΔH_f, kcal/mol:	-189.47
Dipole, Da:	4.99
IP(EA), eV:	-9.28(-1.11)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 2-[3-(dimethylamino)phenyl]-4,5-dihydro-1,3-oxazole-4-carboxylate

Drug info:

PubChemData

Smile

CC(C)(C)C1=CC(=C(C=C1)C(CC2=CC=CC=C2)C(=O)NC3=C(C(=C(C(=C3F)F)F)F)F)C4=CC=CC=C4

DOS

IR

Vibrations