Geometry & MOs

Info

ID:	442147
PubChem CID:	135250092
Reduced:	O2N4H16C17 (1)
Stoich.:	A2B4C16D17 (1)
Weight, g/mol:	582.230728
ΔH_f, kcal/mol:	47.49
Dipole, Da:	2.33
IP(EA), eV:	-8.72(-1.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[4-[9-[4-(4,5-dihydro-1,3-oxazol-2-yl)phenyl]-7-phenyl-7H-benzo[c]fluoren-5-yl]phenyl]-4,5-dihydro-1,3-oxazole

Drug info:

PubChemData

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CC(C)(C#CC1=CC=CN2C1=C(C=N2)C3=CN=C(N=C3)OC)O

DOS

IR

Vibrations