Geometry & MOs

Info

ID:	340959
PubChem CID:	127263394
Reduced:	NCl2O3H13C16 (1)
Stoich.:	AB2C3D13E16 (1)
Weight, g/mol:	246.113506
ΔH_f, kcal/mol:	-90.38
Dipole, Da:	2.24
IP(EA), eV:	-8.97(-0.88)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

prop-2-enyl 2,7-diazaspiro[3.5]nonane-7-carboxylate;hydrochloride

Drug info:

PubChemData

Smile

COC(=O)C1=CC2=C(C=C1)OC(CN2)C3=C(C=C(C=C3)Cl)Cl

DOS

IR

Vibrations