Geometry & MOs

Info

ID:	330020
PubChem CID:	127247007
Reduced:	O2N5C16H19 (1)
Stoich.:	A2B5C16D19 (1)
Weight, g/mol:	349.19026
ΔH_f, kcal/mol:	-9.04
Dipole, Da:	4.8
IP(EA), eV:	-8.78(-0.55)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1-ethylindol-3-yl)-[2-[6-(methylamino)pyrazin-2-yl]pyrrolidin-1-yl]methanone

Drug info:

PubChemData

Smile

CNC1=NC(=CN=C1)C2CCCN2C(=O)C3=CN=C(C=C3)OC

DOS

IR

Vibrations