Geometry & MOs

Info

ID:	23587
PubChem CID:	604748
Reduced:	NO3C14H17 (1)
Stoich.:	AB3C14D17 (1)
Weight, g/mol:	247.120843
ΔH_f, kcal/mol:	-94.02
Dipole, Da:	2.7
IP(EA), eV:	-9.69(-0.54)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 2-phenyl-5-propan-2-yl-4,5-dihydro-1,3-oxazole-4-carboxylate

Drug info:

PubChemData

Smile

CC(C)C1C(N=C(O1)C2=CC=CC=C2)C(=O)OC

DOS

IR

Vibrations