Geometry & MOs

Info

ID:	345602
PubChem CID:	127269902
Reduced:	O2N5C21H37 (1)
Stoich.:	A2B5C21D37 (1)
Weight, g/mol:	324.252526
ΔH_f, kcal/mol:	-133.07
Dipole, Da:	4.66
IP(EA), eV:	-8.77(1.23)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(1,2,3,5,6,7,8,8a-octahydroindolizin-1-yl)-3-[2-(2,2-dimethylmorpholin-4-yl)ethyl]urea

Drug info:

PubChemData

Smile

C1CCC(CC1)NC(=O)NC2CCN(CC2)C(=O)NC3CCN4C3CCCC4

DOS

IR

Vibrations