Geometry & MOs

Info

ID:	146241
PubChem CID:	53658799
Reduced:	NO3H6C7 (2)
Stoich.:	AB3C6D7 (2)
Weight, g/mol:	363.350115
ΔH_f, kcal/mol:	-42.08
Dipole, Da:	4.36
IP(EA), eV:	-9.36(-1.39)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(4-methylpiperidin-1-yl)octadec-9-en-1-one

Drug info:

PubChemData

Smile

COC1=C(C=C(C=C1)[N+](=O)[O-])C2=CC(=C(C=C2)OC)[N+](=O)[O-]

DOS

IR

Vibrations