Geometry & MOs

Info

ID:	27748
PubChem CID:	823400
Reduced:	NO2H19C20 (1)
Stoich.:	AB2C19D20 (1)
Weight, g/mol:	317.235479
ΔH_f, kcal/mol:	-33.46
Dipole, Da:	6.05
IP(EA), eV:	-8.41(-0.37)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(4-tert-butylphenoxy)-N-cyclooctylacetamide

Drug info:

PubChemData

Smile

CC(C)OC1=CC=C(C=C1)C(=O)NC2=CC3=CC=CC=C3C=C2

DOS

IR

Vibrations