Geometry & MOs

Info

ID:	424338
PubChem CID:	135122289
Reduced:	FON2H5C8 (1)
Stoich.:	ABC2D5E8 (1)
Weight, g/mol:	365.112404
ΔH_f, kcal/mol:	-7.25
Dipole, Da:	3.01
IP(EA), eV:	-9.64(-1.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[[5-(2,1,3-benzoxadiazol-5-yl)-1H-indole-2-carbonyl]amino]ethylcarbamic acid

Drug info:

PubChemData

Smile

C1=CN=C(N=C1)C2=COC(=C2)F

DOS

IR

Vibrations