Geometry & MOs

Info

ID:	244987
PubChem CID:	99431932
Reduced:	N2O6H22C23 (1)
Stoich.:	A2B6C22D23 (1)
Weight, g/mol:	457.163771
ΔH_f, kcal/mol:	-192.31
Dipole, Da:	4.97
IP(EA), eV:	-9.26(-1.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-[1-(2-oxo-6-phenyl-1H-pyridine-3-carbonyl)piperidine-4-carbonyl]-4H-1,4-benzoxazin-3-one

Drug info:

PubChemData

Smile

COC(=O)C1=CC=CC(=C1)C(=O)N2CCC(CC2)C(=O)C3=CC4=C(C=C3)OCC(=O)N4

DOS

IR

Vibrations