Geometry & MOs

Info

ID:	346199
PubChem CID:	127270690
Reduced:	SO2N6C13H20 (1)
Stoich.:	AB2C6D13E20 (1)
Weight, g/mol:	391.221954
ΔH_f, kcal/mol:	-7.25
Dipole, Da:	6.15
IP(EA), eV:	-9.39(-1.05)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(6-methyl-2-morpholin-4-yl-4-oxo-1H-pyrimidin-5-yl)-N-(5-oxo-1-propan-2-ylpyrrolidin-3-yl)propanamide

Drug info:

PubChemData

Smile

CC(C)N1CC(CC1=O)NC(=O)CSC2=NN=NN2C3CC3

DOS

IR

Vibrations