Geometry & MOs

Info

ID:	307148
PubChem CID:	125275420
Reduced:	ClO2N5H18C20 (1)
Stoich.:	AB2C5D18E20 (1)
Weight, g/mol:	357.18009
ΔH_f, kcal/mol:	31.51
Dipole, Da:	1.88
IP(EA), eV:	-9.37(-0.86)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[(6R)-3,5-dioxo-6H-1,2,4-triazin-6-yl]-N-[1-(2-methylpropyl)-2,3-dihydroindol-5-yl]propanamide

Drug info:

PubChemData

Smile

CC1=CC(=NC(=N1)N2C(=O)[C@@H]3C(=O)[C@H](C(=NC3=N2)C)CC4=CC=C(C=C4)Cl)C

DOS

IR

Vibrations