Geometry & MOs

Info

ID:	7559
PubChem CID:	73375
Reduced:	O3N7C30H33 (1)
Stoich.:	A3B7C30D33 (1)
Weight, g/mol:	539.264488
ΔH_f, kcal/mol:	-38.73
Dipole, Da:	4.13
IP(EA), eV:	-8.75(0.09)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-N,6-N,10-N-triphenyl-2,6,10,13-tetrazatricyclo[7.3.1.05,13]tridecane-2,6,10-tricarboxamide

Drug info:

PubChemData

Smile

C1CN(C2CCN(C3N2C1N(CC3)C(=O)NC4=CC=CC=C4)C(=O)NC5=CC=CC=C5)C(=O)NC6=CC=CC=C6

DOS

IR

Vibrations