Geometry & MOs

Info

ID:	329962
PubChem CID:	127246949
Reduced:	ON6C19H22 (1)
Stoich.:	AB6C19D22 (1)
Weight, g/mol:	336.158626
ΔH_f, kcal/mol:	44.3
Dipole, Da:	7.11
IP(EA), eV:	-8.93(-0.46)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CNC1=NC(=CN=C1)C2CCCN2C(=O)CCN3C=NC4=CC=CC=C43

DOS

IR

Vibrations