Geometry & MOs

Info

ID:	366468
PubChem CID:	127319957
Reduced:	SN3O3C18H31 (1)
Stoich.:	AB3C3D18E31 (1)
Weight, g/mol:	312.161997
ΔH_f, kcal/mol:	-123.76
Dipole, Da:	4.89
IP(EA), eV:	-8.49(0.74)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-methyl-2-(1-oxo-1,4-thiazinan-4-yl)propyl]-2-(4-methylpyrazol-1-yl)acetamide

Drug info:

PubChemData

Smile

CC(C)(CNC(=O)C1CCCN(C1)C(=O)C2CC2)N3CCS(=O)CC3

DOS

IR

Vibrations