Geometry & MOs

Info

ID:	441232
PubChem CID:	135233736
Reduced:	OS2N5C26H39 (1)
Stoich.:	AB2C5D26E39 (1)
Weight, g/mol:	575.199762
ΔH_f, kcal/mol:	-3.38
Dipole, Da:	1.87
IP(EA), eV:	-8.1(-0.07)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(9-phenanthren-3-yldibenzofuran-2-yl)-4,6-diphenyl-1,3,5-triazine

Drug info:

PubChemData

Smile

CC(C)(C)CNC1=C(N=C(C=C1)C2CCCN(C2)SC3=CC=C(C=C3)SN4CCOCC4)NC

DOS

IR

Vibrations