Geometry & MOs

Info

ID:	386874
PubChem CID:	134983209
Reduced:	NH23C24 (1)
Stoich.:	AB23C24 (1)
Weight, g/mol:	439.92344
ΔH_f, kcal/mol:	55.18
Dipole, Da:	1.21
IP(EA), eV:	-8.7(0.32)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,6-dibromo-4-(2,3-diphenylcycloprop-2-en-1-ylidene)cyclohexa-2,5-dien-1-one

Drug info:

PubChemData

Smile

CC1=C2[C@H]3[C@H](CC4=CC=CC=C34)[C@@H](NC2=C(C=C1)C)C5=CC=CC=C5

DOS

IR

Vibrations