Geometry & MOs

Info

ID:	367700
PubChem CID:	127325451
Reduced:	N2S2O4C13H20 (1)
Stoich.:	A2B2C4D13E20 (1)
Weight, g/mol:	270.148061
ΔH_f, kcal/mol:	-193.21
Dipole, Da:	8.1
IP(EA), eV:	-8.58(-0.13)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-3-pyridin-3-ylbutan-1-one

Drug info:

PubChemData

Smile

CC1=C(SC(=O)N1CCC(=O)NC2CCCS(=O)(=O)C2)C

DOS

IR

Vibrations