Geometry & MOs

Info

ID:	402247
PubChem CID:	135055202
Reduced:	NH21C24 (1)
Stoich.:	AB21C24 (1)
Weight, g/mol:	720.274778
ΔH_f, kcal/mol:	120.59
Dipole, Da:	1.76
IP(EA), eV:	-8.97(-0.19)
Spin(S_z, S²):	None, None
Charge, e:	-1

Chem-info

IUPAC name:

None

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)CCC=NC2=CC=CC=C2CC#CC3=CC=CC=C3

DOS

IR

Vibrations