Geometry & MOs

Info

ID:	319768
PubChem CID:	126657251
Reduced:	O3C17H28 (1)
Stoich.:	A3B17C28 (1)
Weight, g/mol:	259.095691
ΔH_f, kcal/mol:	-150.17
Dipole, Da:	4.22
IP(EA), eV:	-10.15(2.0)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(4-oxo-4a,8a-dihydroquinazolin-3-yl)piperidine-2,6-dione

Drug info:

PubChemData

Smile

CC1(CCCC2[C@H]3C2C(C(CC1)O)C4CC4C3(C)O)O

DOS

IR

Vibrations