Geometry & MOs

Info

ID:	368633
PubChem CID:	127329703
Reduced:	SO4N5C13H19 (1)
Stoich.:	AB4C5D13E19 (1)
Weight, g/mol:	365.152161
ΔH_f, kcal/mol:	-47.95
Dipole, Da:	4.21
IP(EA), eV:	-9.22(-0.28)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(5-methyl-1,2-oxazol-3-yl)-N-[[2-(4-methylpiperazin-1-yl)pyridin-4-yl]methyl]methanesulfonamide

Drug info:

PubChemData

Smile

CC1=CC(=NO1)CS(=O)(=O)N2CCN(CC2)CC3=NC(=NO3)C

DOS

IR

Vibrations