Geometry & MOs

Info

ID:	343751
PubChem CID:	127266927
Reduced:	FO2N5C16H20 (1)
Stoich.:	AB2C5D16E20 (1)
Weight, g/mol:	308.184841
ΔH_f, kcal/mol:	-77.67
Dipole, Da:	5.32
IP(EA), eV:	-8.49(-0.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-butyl-2-[3-(2,4-dioxo-1H-pyrimidin-6-yl)pyrrolidin-1-yl]propanamide

Drug info:

PubChemData

Smile

C1CN(CC1C2=CC(=O)NN2)CCC(=O)NC3=C(C=CC(=C3)N)F

DOS

IR

Vibrations