Geometry & MOs

Info

ID:	352397
PubChem CID:	127283484
Reduced:	SO3N4C19H26 (1)
Stoich.:	AB3C4D19E26 (1)
Weight, g/mol:	368.130697
ΔH_f, kcal/mol:	-118.71
Dipole, Da:	1.85
IP(EA), eV:	-9.4(-0.46)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

8-methyl-3-[2-oxo-2-[2-(1,3-thiazol-2-yl)piperidin-1-yl]ethyl]quinazolin-4-one

Drug info:

PubChemData

Smile

CC1CCC2(CC1)C(=O)N(C(=O)N2)CC(=O)N3CCCCC3C4=NC=CS4

DOS

IR

Vibrations