Geometry & MOs

Info

ID:	22470
PubChem CID:	597347
Reduced:	O2N3C16H19 (1)
Stoich.:	A2B3C16D19 (1)
Weight, g/mol:	285.147727
ΔH_f, kcal/mol:	-25.22
Dipole, Da:	5.36
IP(EA), eV:	-9.38(-0.54)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-cyanoethyl)-6-(4-cyanophenoxy)hexanamide

Drug info:

PubChemData

Smile

C1=CC(=CC=C1C#N)OCCCCCC(=O)NCCC#N

DOS

IR

Vibrations