Geometry & MOs

Info

ID:	317731
PubChem CID:	126645569
Reduced:	NO6H15C18 (1)
Stoich.:	AB6C15D18 (1)
Weight, g/mol:	411.179421
ΔH_f, kcal/mol:	-192.06
Dipole, Da:	6.17
IP(EA), eV:	-9.33(-1.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-benzyl-7-N-hydroxy-2-N-(oxan-4-yl)-2,3-dihydro-1,4-benzoxazine-2,7-dicarboxamide

Drug info:

PubChemData

Smile

COC(=O)C1=CC2=C(C=C1)OCC(=O)N2CC3=CC(=CC=C3)C(=O)O

DOS

IR

Vibrations