Geometry & MOs

Info

ID:	320096
PubChem CID:	126658190
Reduced:	OH14C16 (1)
Stoich.:	AB14C16 (1)
Weight, g/mol:	288.12224
ΔH_f, kcal/mol:	24.03
Dipole, Da:	1.38
IP(EA), eV:	-8.55(-0.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-amino-3-[(3S)-2-hydroxy-6-oxopiperidin-3-yl]-2-methylquinazolin-4-one

Drug info:

PubChemData

Smile

C[C@H]1CC12C3=CC=CC=C3OC4=CC=CC=C24

DOS

IR

Vibrations