Geometry & MOs

Info

ID:	89351
PubChem CID:	49960639
Reduced:	SO3N4C14H18 (1)
Stoich.:	AB3C4D14E18 (1)
Weight, g/mol:	293.119798
ΔH_f, kcal/mol:	-92.79
Dipole, Da:	3.5
IP(EA), eV:	-9.2(-0.9)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-methoxy-N-(4-methylpiperazine-1-carbothioyl)benzamide

Drug info:

PubChemData

Smile

CC(=O)NC(=S)NNC(=O)CCC(=O)NCC1=CC=CC=C1

DOS

IR

Vibrations