Geometry & MOs

Info

ID:	365923
PubChem CID:	127319188
Reduced:	ON5C20H27 (1)
Stoich.:	AB5C20D27 (1)
Weight, g/mol:	326.195405
ΔH_f, kcal/mol:	-4.68
Dipole, Da:	2.72
IP(EA), eV:	-9.5(0.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[2-(3,3-dimethylmorpholin-4-yl)ethyl]-3-[2-(2,5-dioxopyrrolidin-1-yl)ethyl]urea

Drug info:

PubChemData

Smile

CC1=NN2CC(CCC2=N1)NC(=O)NC3(CCCCC3)C4=CC=CC=C4

DOS

IR

Vibrations