Geometry & MOs

Info

ID:	244983
PubChem CID:	99431928
Reduced:	N3O6C22H23 (1)
Stoich.:	A3B6C22D23 (1)
Weight, g/mol:	409.130757
ΔH_f, kcal/mol:	-197.74
Dipole, Da:	5.47
IP(EA), eV:	-9.21(-0.98)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(2S)-1-oxo-1-[4-(3-oxo-4H-1,4-benzoxazine-6-carbonyl)piperidin-1-yl]propan-2-yl]methanesulfonamide

Drug info:

PubChemData

Smile

CC1=C(C=CO1)C(=O)NCC(=O)N2CCC(CC2)C(=O)C3=CC4=C(C=C3)OCC(=O)N4

DOS

IR

Vibrations