Geometry & MOs

Info

ID:	17558
PubChem CID:	504598
Reduced:	FN2O2H9C14 (1)
Stoich.:	AB2C2D9E14 (1)
Weight, g/mol:	256.064806
ΔH_f, kcal/mol:	-63.27
Dipole, Da:	1.95
IP(EA), eV:	-9.26(-1.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-amino-7-(3-fluorophenyl)-3,1-benzoxazin-4-one

Drug info:

PubChemData

Smile

C1=CC(=CC(=C1)F)C2=CC3=C(C=C2)C(=O)OC(=N3)N

DOS

IR

Vibrations