Geometry & MOs

Info

ID:	317780
PubChem CID:	126645745
Reduced:	N2O5C18H18 (1)
Stoich.:	A2B5C18D18 (1)
Weight, g/mol:	354.157957
ΔH_f, kcal/mol:	-120.42
Dipole, Da:	1.48
IP(EA), eV:	-9.0(-0.83)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[(4-tert-butylphenyl)methyl]-N-hydroxy-3-oxo-1,4-benzoxazine-6-carboxamide

Drug info:

PubChemData

Smile

C[C@@H]1C(=O)N(C2=C(O1)C=CC(=C2)C(=O)NO)CC3=CC=C(C=C3)OC

DOS

IR

Vibrations