Geometry & MOs

Info

ID:	430044
PubChem CID:	135170101
Reduced:	ON4H12C17 (1)
Stoich.:	AB4C12D17 (1)
Weight, g/mol:	319.168462
ΔH_f, kcal/mol:	85.02
Dipole, Da:	7.69
IP(EA), eV:	-7.92(-1.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

spiro[4-azatricyclo[4.3.1.13,8]undecane-5,3'-pyrido[3,2-f][1,4]benzoxazine]

Drug info:

PubChemData

Smile

C1=CC=C2C(=C1)NC(=CN=C3C4=C(C=CC3=O)N=CC=C4)N2

DOS

IR

Vibrations