Geometry & MOs

Info

ID:	85487
PubChem CID:	49875812
Reduced:	NO2C14H15 (1)
Stoich.:	AB2C14D15 (1)
Weight, g/mol:	478.05282
ΔH_f, kcal/mol:	1.29
Dipole, Da:	2.53
IP(EA), eV:	-10.26(0.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(3-bromophenyl)-3-(4-methoxyphenyl)-5-phenyl-3a,6a-dihydro-3H-pyrrolo[3,4-d][1,2]oxazole-4,6-dione

Drug info:

PubChemData

Smile

C=CCN1C(=O)C2C3C=CC(C2C1=O)C4C3C4

DOS

IR

Vibrations