Geometry & MOs

Info

ID:	123284
PubChem CID:	50840628
Reduced:	SO2N4H22C24 (1)
Stoich.:	AB2C4D22E24 (1)
Weight, g/mol:	433.107183
ΔH_f, kcal/mol:	15.2
Dipole, Da:	5.96
IP(EA), eV:	-8.47(-0.91)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(4-methoxyphenyl)-2-[6-methyl-2-[4-(trifluoromethyl)phenyl]pyrimidin-4-yl]sulfanylacetamide

Drug info:

PubChemData

Smile

C1CN(CCC1C(=O)NC2=CC=CC=C2)C3=NC4=C(C(=O)N3C5=CC=CC=C5)SC=C4

DOS

IR

Vibrations