Geometry & MOs

Info

ID:	19143
PubChem CID:	555434
Reduced:	NO2H10C12 (2)
Stoich.:	AB2C10D12 (2)
Weight, g/mol:	400.142307
ΔH_f, kcal/mol:	-45.16
Dipole, Da:	3.99
IP(EA), eV:	-9.12(-0.9)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-benzoyl-6a-methyl-2,6-diphenyl-3,3a-dihydro-[1,3]oxazolo[5,4-d][1,2]oxazol-5-one

Drug info:

PubChemData

Smile

CC12C(C(N(O1)C3=CC=CC=C3)C(=O)C4=CC=CC=C4)OC(=O)N2C5=CC=CC=C5

DOS

IR

Vibrations