Geometry & MOs

Info

ID:	366924
PubChem CID:	127321901
Reduced:	ON3C15H19 (1)
Stoich.:	AB3C15D19 (1)
Weight, g/mol:	393.205242
ΔH_f, kcal/mol:	2.02
Dipole, Da:	4.57
IP(EA), eV:	-9.39(-0.96)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[2-(2-azaspiro[5.5]undec-9-en-2-yl)-2-oxoethyl]-1-benzylpyrimidine-2,4-dione

Drug info:

PubChemData

Smile

C1CC2(CCC=CC2)CN(C1)C(=O)C3=NC=CN=C3

DOS

IR

Vibrations