Geometry & MOs

Info

ID:	349173
PubChem CID:	127274899
Reduced:	O3N7C12H15 (1)
Stoich.:	A3B7C12D15 (1)
Weight, g/mol:	399.179421
ΔH_f, kcal/mol:	19.52
Dipole, Da:	2.5
IP(EA), eV:	-9.76(-0.87)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-methyl-6-[1-(6-oxopiperidine-3-carbonyl)piperidine-4-carbonyl]-4H-1,4-benzoxazin-3-one

Drug info:

PubChemData

Smile

CC1=CC(=NO1)C(=O)N2CCN(CC2)C(=O)CN3C=NN=N3

DOS

IR

Vibrations