Geometry & MOs

Info

ID:	269261
PubChem CID:	103616633
Reduced:	ClON5C11H12 (1)
Stoich.:	ABC5D11E12 (1)
Weight, g/mol:	283.14331
ΔH_f, kcal/mol:	25.87
Dipole, Da:	5.76
IP(EA), eV:	-10.05(-1.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(4-ethyl-1,2,4-triazol-3-yl)methyl]-2-(1H-indol-3-yl)acetamide

Drug info:

PubChemData

Smile

CCN1C=NN=C1CNC(=O)C2=NC=CC(=C2)Cl

DOS

IR

Vibrations