Geometry & MOs

Info

ID:

325010

PubChem CID:

126679220

Reduced:

BrNO2H10C18 (1)

Stoich.:

ABC2D10E18 (1)

Weight, g/mol:

600.220164

ΔHf, kcal/mol:

75.2

Dipole, Da:

1.64

IP(EA), eV:

 -9.04(-1.56)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

24-anthracen-9-yl-15-phenyl-4-oxa-15,24-diazaheptacyclo[14.11.0.02,14.03,11.05,10.017,25.018,23]heptacosa-1(16),2(14),5,7,9,12,17(25),18,20,22,26-undecaene

Drug info:

PubChemData

Smile

C1=CC=C2C(=C1)C3=C(O2)C(=CC=C3)C4=C(C=CC=C4Br)N=O

DOS

IR

Vibrations