Geometry & MOs

Info

ID:	361051
PubChem CID:	127301941
Reduced:	ON4C16H22 (1)
Stoich.:	AB4C16D22 (1)
Weight, g/mol:	344.184841
ΔH_f, kcal/mol:	-2.09
Dipole, Da:	6.46
IP(EA), eV:	-8.79(-0.84)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(2,4-dioxo-1H-quinazolin-3-yl)-N-[(1-ethylpiperidin-2-yl)methyl]acetamide

Drug info:

PubChemData

Smile

CCN1CCCCC1CNC(=O)C2=CC=CC3=C2NN=C3

DOS

IR

Vibrations