Geometry & MOs

Info

ID:	367865
PubChem CID:	127325998
Reduced:	NO2C11H12 (2)
Stoich.:	AB2C11D12 (2)
Weight, g/mol:	393.168856
ΔH_f, kcal/mol:	-108.18
Dipole, Da:	7.42
IP(EA), eV:	-8.94(-0.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N,2-dimethyl-3-oxo-N-(2-oxo-1-phenylpiperidin-3-yl)-4H-1,4-benzoxazine-8-carboxamide

Drug info:

PubChemData

Smile

CN(C1CCCN(C1=O)C2=CC=CC=C2)C(=O)C3=CC4=C(C=C3)OCCCO4

DOS

IR

Vibrations