Geometry & MOs

Info

ID:	49842
PubChem CID:	11533944
Reduced:	O4N7C29H29 (1)
Stoich.:	A4B7C29D29 (1)
Weight, g/mol:	539.22944
ΔH_f, kcal/mol:	-37.92
Dipole, Da:	3.84
IP(EA), eV:	-9.19(-0.97)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[2,3,5,6-tetrakis(4-iminopyridin-1-yl)pyridin-4-yl]pyridin-4-imine

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)C2=C(C(=NN2C3=CC=CC=C3)C(=O)NC4=CC=C(C=C4)C(=O)O)NC(=O)CCCCN=C(N)N

DOS

IR

Vibrations