Geometry & MOs

Info

ID:	196162
PubChem CID:	78791619
Reduced:	ON2S2C11H12 (1)
Stoich.:	AB2C2D11E12 (1)
Weight, g/mol:	259.157229
ΔH_f, kcal/mol:	14.33
Dipole, Da:	4.14
IP(EA), eV:	-8.84(-0.58)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(2,3-dihydro-1H-inden-5-yl)-4-oxo-N-propylbutanamide

Drug info:

PubChemData

Smile

CN1C=CSC1=NC(=O)CCC2=CC=CS2

DOS

IR

Vibrations