Geometry & MOs

Info

ID:	142422
PubChem CID:	53031859
Reduced:	FO3N5H20C22 (1)
Stoich.:	AB3C5D20E22 (1)
Weight, g/mol:	360.12224
ΔH_f, kcal/mol:	-29.93
Dipole, Da:	3.94
IP(EA), eV:	-9.16(-1.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-ethyl-6-[5-(1H-indol-4-yl)-1,2,4-oxadiazol-3-yl]-1,4-benzoxazin-3-one

Drug info:

PubChemData

Smile

C1COCCN1C(=O)CCN2C=NC3=C2C=CC(=C3)C4=NOC(=N4)C5=CC=C(C=C5)F

DOS

IR

Vibrations