Geometry & MOs

Info

ID:	329991
PubChem CID:	127246978
Reduced:	SO2N6C15H22 (1)
Stoich.:	AB2C6D15E22 (1)
Weight, g/mol:	302.120132
ΔH_f, kcal/mol:	-16.38
Dipole, Da:	7.63
IP(EA), eV:	-8.84(-0.32)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CCN1C(=C(C=N1)S(=O)(=O)N2CCCC2C3=CN=CC(=N3)NC)C

DOS

IR

Vibrations