Geometry & MOs

Info

ID:	366432
PubChem CID:	127319921
Reduced:	SN3O3C16H25 (1)
Stoich.:	AB3C3D16E25 (1)
Weight, g/mol:	336.150764
ΔH_f, kcal/mol:	-101.34
Dipole, Da:	2.77
IP(EA), eV:	-8.41(-0.6)
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]-2,3-dihydro-1-benzofuran-2-carboxamide

Drug info:

PubChemData

Smile

CCOC1=C(C=CC=N1)C(=O)NCC(C)(C)N2CCS(=O)CC2

DOS

IR

Vibrations