Geometry & MOs

Info

ID:	366451
PubChem CID:	127319940
Reduced:	SN3O3C15H23 (1)
Stoich.:	AB3C3D15E23 (1)
Weight, g/mol:	360.138675
ΔH_f, kcal/mol:	-100.24
Dipole, Da:	5.61
IP(EA), eV:	-8.47(-0.88)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(4-chloro-3,5-dimethylpyrazol-1-yl)-N-[2-methyl-2-(1-oxo-1,4-thiazinan-4-yl)propyl]acetamide

Drug info:

PubChemData

Smile

CC(C)(CNC(=O)C1=CC(=O)N(C=C1)C)N2CCS(=O)CC2

DOS

IR

Vibrations