Geometry & MOs

Info

ID:	84790
PubChem CID:	49869904
Reduced:	ON2C27H48 (1)
Stoich.:	AB2C27D48 (1)
Weight, g/mol:	502.461063
ΔH_f, kcal/mol:	-40.52
Dipole, Da:	3.4
IP(EA), eV:	-9.5(0.71)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-[bis(2-aminoethyl)amino]ethyl]pentacosa-10,12-diynamide

Drug info:

PubChemData

Smile

CCCCCCCCCCCCC#CC#CCCCCCCCCC(=O)NCCN

DOS

IR

Vibrations