Geometry & MOs

Info

ID:	298156
PubChem CID:	117647812
Reduced:	NH13C19 (1)
Stoich.:	AB13C19 (1)
Weight, g/mol:	555.13101
ΔH_f, kcal/mol:	82.92
Dipole, Da:	1.84
IP(EA), eV:	-8.59(-0.83)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

7-bromo-17-carbazol-9-yl-10,10,20,20-tetramethyl-2,12-diazapentacyclo[11.7.0.03,11.04,9.014,19]icosa-1(13),2,4(9),5,7,11,14(19),15,17-nonaene

Drug info:

PubChemData

Smile

C1C2=CC=CC=C2C3=NC4=C(C=C31)C5=CC=CC=C5C4

DOS

IR

Vibrations