Geometry & MOs

Info

ID:	126219
PubChem CID:	50955701
Reduced:	O3N5C20H25 (1)
Stoich.:	A3B5C20D25 (1)
Weight, g/mol:	321.184112
ΔH_f, kcal/mol:	-32.85
Dipole, Da:	1.52
IP(EA), eV:	-8.57(-0.31)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(1-methylindol-3-yl)-N-propyl-N-(pyridin-3-ylmethyl)acetamide

Drug info:

PubChemData

Smile

CN1C2=CC=CC=C2N=C1C3=NN4CCCN(CC4=C3)C(=O)COCCOC

DOS

IR

Vibrations