Geometry & MOs

Info

ID:	275793
PubChem CID:	103817797
Reduced:	BrON2C15H17 (1)
Stoich.:	ABC2D15E17 (1)
Weight, g/mol:	348.01095
ΔH_f, kcal/mol:	18.73
Dipole, Da:	2.02
IP(EA), eV:	-7.64(-0.11)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-[(5-bromo-2-hydroxyphenyl)methylamino]-4H-1,4-benzoxazin-3-one

Drug info:

PubChemData

Smile

C1CCN(C1)C2=CC=C(C=C2)NCC3=C(C=CO3)Br

DOS

IR

Vibrations