Geometry & MOs

Info

ID:	377493
PubChem CID:	134223548
Reduced:	ON2H36C55 (1)
Stoich.:	AB2C36D55 (1)
Weight, g/mol:	334.99458
ΔH_f, kcal/mol:	188.53
Dipole, Da:	1.55
IP(EA), eV:	-8.01(-0.78)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

10-bromo-7H-[1]benzofuro[2,3-b]carbazole

Drug info:

PubChemData

Smile

CC1(C2=CC=CC=C2C3=C1C=C4C(=C3)C5=C(N4C6=CC7=CC=CC=C7C=C6)C=CC(=C5)C8=CC9=C(C=C8)OC1=C9C=C2C3=CC=CC=C3N(C2=C1)C1=CC=CC=C1)C

DOS

IR

Vibrations