Geometry & MOs

Info

ID:	444598
PubChem CID:	135262984
Reduced:	SN3O5C32H41 (1)
Stoich.:	AB3C5D32E41 (1)
Weight, g/mol:	482.187543
ΔH_f, kcal/mol:	-164.74
Dipole, Da:	9.41
IP(EA), eV:	-8.74(-0.32)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(2,4-dimethylphenyl)-(5-methylfuran-2-yl)methyl]-2-[3-(1,1-dioxo-1,4-thiazinan-4-yl)-4-hydroxyphenyl]acetamide

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1)C(C2=CC=C(O2)C)NC(=O)CC3=CC(=C(C=C3)COC)N4CCS(=O)(=O)CC4)N5CCCCC5

DOS

IR

Vibrations