Geometry & MOs

Info

ID:	345600
PubChem CID:	127269900
Reduced:	ON2C7H12 (2)
Stoich.:	AB2C7D12 (2)
Weight, g/mol:	293.185175
ΔH_f, kcal/mol:	-103.61
Dipole, Da:	4.81
IP(EA), eV:	-8.73(0.64)
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-[1-(3-methyl-1,2,4-oxadiazol-5-yl)ethyl]urea

Drug info:

PubChemData

Smile

C1CCN2CCC(C2C1)NC(=O)NC3CCCNC3=O

DOS

IR

Vibrations