Geometry & MOs

Info

ID:	31555
PubChem CID:	855865
Reduced:	SN3O3H15C17 (1)
Stoich.:	AB3C3D15E17 (1)
Weight, g/mol:	329.156184
ΔH_f, kcal/mol:	-28.56
Dipole, Da:	2.9
IP(EA), eV:	-8.96(-1.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2,6-diethylphenyl)-2-(4,6-dimethylpyrimidin-2-yl)sulfanylacetamide

Drug info:

PubChemData

Smile

CC1=CC(=CC=C1)NC(=O)CSC2=NN=C(O2)C3=CC(=CC=C3)O

DOS

IR

Vibrations