Geometry & MOs

Info

ID:	12014
PubChem CID:	125976
Reduced:	N4H17C22 (2)
Stoich.:	A4B17C22 (2)
Weight, g/mol:	674.290643
ΔH_f, kcal/mol:	299.33
Dipole, Da:	2.79
IP(EA), eV:	-8.04(-1.57)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[10,15,20-tris(2-aminophenyl)-21,24-dihydroporphyrin-5-yl]aniline

Drug info:

PubChemData

Smile

C1=CC=C(C(=C1)C2=C3C=CC(=C(C4=CC=C(N4)C(=C5C=CC(=N5)C(=C6C=CC2=N6)C7=CC=CC=C7N)C8=CC=CC=C8N)C9=CC=CC=C9N)N3)N

DOS

IR

Vibrations