Geometry & MOs

Info

ID:	423236
PubChem CID:	135119154
Reduced:	ON2C11H12 (2)
Stoich.:	AB2C11D12 (2)
Weight, g/mol:	333.216475
ΔH_f, kcal/mol:	5.14
Dipole, Da:	4.96
IP(EA), eV:	-8.37(-0.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[1-(6-ethyl-2-morpholin-4-ylpyrimidin-4-yl)pyrrolidin-3-yl]-N-methylacetamide

Drug info:

PubChemData

Smile

C1CC1C2=CC(=NN2)C(=O)N3CCC4(CC3)C5=C(CCO4)C6=CC=CC=C6N5

DOS

IR

Vibrations