Geometry & MOs

Info

ID:	183343
PubChem CID:	77010788
Reduced:	N3O3C14H19 (1)
Stoich.:	A3B3C14D19 (1)
Weight, g/mol:	295.108754
ΔH_f, kcal/mol:	-36.89
Dipole, Da:	5.2
IP(EA), eV:	-8.22(-0.41)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[4-[(4-chloro-2-methylphenoxy)methyl]piperidin-2-ylidene]-nitrosomethanamine

Drug info:

PubChemData

Smile

COC1=CC=C(C=C1)OCC2CCNC(=C(N)N=O)C2

DOS

IR

Vibrations