Geometry & MOs

Info

ID:	263955
PubChem CID:	103409725
Reduced:	O2N3C12H23 (1)
Stoich.:	A2B3C12D23 (1)
Weight, g/mol:	280.142307
ΔH_f, kcal/mol:	-53.26
Dipole, Da:	2.9
IP(EA), eV:	-9.18(0.88)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

7-amino-4-[3-(2-methoxyethoxy)propyl]-1,4-benzoxazin-3-one

Drug info:

PubChemData

Smile

CN1C(=CC=N1)CCNCCCOCCOC

DOS

IR

Vibrations