Geometry & MOs

Info

ID:	366458
PubChem CID:	127319947
Reduced:	SO2N6C16H22 (1)
Stoich.:	AB2C6D16E22 (1)
Weight, g/mol:	378.197714
ΔH_f, kcal/mol:	28.67
Dipole, Da:	9.19
IP(EA), eV:	-8.65(-1.33)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(3-methoxy-4-methylphenyl)-N-[2-methyl-2-(1-oxo-1,4-thiazinan-4-yl)propyl]cyclopropane-1-carboxamide

Drug info:

PubChemData

Smile

CC(C)(CNC(=O)C1=CC(=CC=C1)N2C=NN=N2)N3CCS(=O)CC3

DOS

IR

Vibrations