Geometry & MOs

Info

ID:	366455
PubChem CID:	127319944
Reduced:	SN3O3C17H31 (1)
Stoich.:	AB3C3D17E31 (1)
Weight, g/mol:	371.224263
ΔH_f, kcal/mol:	-149.34
Dipole, Da:	5.22
IP(EA), eV:	-8.35(0.64)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-butanoyl-N-[2-methyl-2-(1-oxo-1,4-thiazinan-4-yl)propyl]piperidine-3-carboxamide

Drug info:

PubChemData

Smile

CC(C)C(C(=O)NCC(C)(C)N1CCS(=O)CC1)N2CCCC2=O

DOS

IR

Vibrations