Geometry & MOs

Info

ID:	361840
PubChem CID:	127304811
Reduced:	SO2N4C19H30 (1)
Stoich.:	AB2C4D19E30 (1)
Weight, g/mol:	378.208947
ΔH_f, kcal/mol:	-89.91
Dipole, Da:	3.86
IP(EA), eV:	-8.85(-0.33)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[3-[4-[(2-methyl-1,3-thiazol-5-yl)methyl]piperazin-1-yl]-3-oxopropyl]cyclohexanecarboxamide

Drug info:

PubChemData

Smile

CC1=NC=C(S1)CN2CCN(CC2)C(=O)C(C)NC(=O)C3CCCCC3

DOS

IR

Vibrations