Geometry & MOs

Info

ID:	355187
PubChem CID:	127288119
Reduced:	O3N4C13H20 (1)
Stoich.:	A3B4C13D20 (1)
Weight, g/mol:	344.184841
ΔH_f, kcal/mol:	-90.38
Dipole, Da:	3.79
IP(EA), eV:	-9.62(-0.41)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(5-ethyl-1,2,4-oxadiazol-3-yl)ethyl]-3,6,6-trimethyl-4-oxo-5,7-dihydro-1H-indole-2-carboxamide

Drug info:

PubChemData

Smile

CCC1=NC(=NO1)CCNC(=O)C2CCCN2C(=O)C

DOS

IR

Vibrations