Geometry & MOs

Info

ID:	147907
PubChem CID:	53787567
Reduced:	ClN2O3H9C13 (1)
Stoich.:	AB2C3D9E13 (1)
Weight, g/mol:	150.140851
ΔH_f, kcal/mol:	9.36
Dipole, Da:	4.73
IP(EA), eV:	-8.6(-1.68)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(4R,6S)-4,6-dimethyl-8-methylidenespiro[2.5]octane

Drug info:

PubChemData

Smile

C1=CC2C(=CC3=C(N2)C(=CC(=C3Cl)O)[N+](=O)[O-])C=C1

DOS

IR

Vibrations