Geometry & MOs

Info

ID:	312449
PubChem CID:	126605338
Reduced:	NPSO7C17H28 (1)
Stoich.:	ABCD7E17F28 (1)
Weight, g/mol:	668.293997
ΔH_f, kcal/mol:	-376.06
Dipole, Da:	2.4
IP(EA), eV:	-9.42(-0.52)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3,8-dimethyl-1-N,6-N-dinaphthalen-1-yl-1-N,6-N-dipyridin-2-yl-2,3-dihydropyrene-1,6-diamine

Drug info:

PubChemData

Smile

CCOP(=O)(C1=CSC(=C1)CC(C(=O)OC)NC(=O)OC(C)(C)C)OCC

DOS

IR

Vibrations