Geometry & MOs

Info

ID:	72656
PubChem CID:	48416405
Reduced:	SO2N6C20H26 (1)
Stoich.:	AB2C6D20E26 (1)
Weight, g/mol:	377.188546
ΔH_f, kcal/mol:	-32.53
Dipole, Da:	4.45
IP(EA), eV:	-8.84(-0.91)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[1-[3-(4,6-dimethyl-2-methylsulfanylpyrimidin-5-yl)propanoyl]piperidin-3-yl]imidazolidin-2-one

Drug info:

PubChemData

Smile

CC1=CC(=CC=C1)C2=NNC(=S)N2CCC(=O)N3CCCC(C3)N4CCNC4=O

DOS

IR

Vibrations