Geometry & MOs

Info

ID:	220772
PubChem CID:	85239280
Reduced:	ON4C9H12 (1)
Stoich.:	AB4C9D12 (1)
Weight, g/mol:	229.146664
ΔH_f, kcal/mol:	16.93
Dipole, Da:	6.04
IP(EA), eV:	-9.19(-1.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(2-oct-1-ynylphenyl)methylidene]hydroxylamine

Drug info:

PubChemData

Smile

CCCCC(=O)NC(=C(C#N)N)C#N

DOS

IR

Vibrations