Geometry & MOs

Info

ID:	133702
PubChem CID:	51576549
Reduced:	N2O2H20C25 (1)
Stoich.:	A2B2C20D25 (1)
Weight, g/mol:	222.173213
ΔH_f, kcal/mol:	23.72
Dipole, Da:	4.86
IP(EA), eV:	-9.28(-0.23)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(NZ)-N-[(8R)-8-piperidin-1-ylcyclooct-4-en-1-ylidene]hydroxylamine

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)[C@@H]2C=C[C@@H]([C@@H]3[C@@H]2C(=O)N(C3=O)C4=CN=CC=C4)C5=CC=CC=C5

DOS

IR

Vibrations