Geometry & MOs

Info

ID:	50152
PubChem CID:	12012659
Reduced:	O3C27H28 (1)
Stoich.:	A3B27C28 (1)
Weight, g/mol:	383.115758
ΔH_f, kcal/mol:	-103.24
Dipole, Da:	5.66
IP(EA), eV:	-9.31(-0.44)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(4-methoxyphenyl)-4-phenylspiro[4H-1,2-oxazole-5,2'-indene]-1',3'-dione

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1)C)C2=C(C(=O)OC3(O2)C4CC5CC(C4)CC3C5)C6=CC=CC=C6

DOS

IR

Vibrations