Geometry & MOs

Info

ID:	60787
PubChem CID:	26702163
Reduced:	N3O3H19C23 (1)
Stoich.:	A3B3C19D23 (1)
Weight, g/mol:	385.079766
ΔH_f, kcal/mol:	-42.93
Dipole, Da:	4.22
IP(EA), eV:	-8.04(-1.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

dimethyl 5-(3-oxo-4H-1,4-benzoxazine-7-carbonyl)oxybenzene-1,3-dicarboxylate

Drug info:

PubChemData

Smile

CCN1C2=C(C=C(C=C2)NC(=O)C3=CC4=C(C=C3)NC(=O)CO4)C5=CC=CC=C51

DOS

IR

Vibrations