Geometry & MOs

Info

ID:	235175
PubChem CID:	92304178
Reduced:	OSN4H22C24 (1)
Stoich.:	ABC4D22E24 (1)
Weight, g/mol:	348.220164
ΔH_f, kcal/mol:	76.26
Dipole, Da:	2.47
IP(EA), eV:	-8.75(-1.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3S)-3-(1-ethylindol-3-yl)-3-(4-methylphenyl)-N-propylpropanamide

Drug info:

PubChemData

Smile

CCC1=CC=C(C=C1)NC(=S)N/N=C/2\C3=CC=CC=C3N(C2=O)CC4=CC=CC=C4

DOS

IR

Vibrations