Geometry & MOs

Info

ID:	137198
PubChem CID:	52167925
Reduced:	O3N4C15H22 (1)
Stoich.:	A3B4C15D22 (1)
Weight, g/mol:	314.174276
ΔH_f, kcal/mol:	-95.5
Dipole, Da:	2.59
IP(EA), eV:	-8.76(-0.51)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-(2,3-dihydroindol-1-yl)-2,4-di(propan-2-yl)-1,2,4-triazine-3,5-dione

Drug info:

PubChemData

Smile

CC1=CC=C(O1)CNC2=NN(C(=O)N(C2=O)C(C)C)C(C)C

DOS

IR

Vibrations