Geometry & MOs

Info

ID:	354841
PubChem CID:	127287601
Reduced:	O2N5C15H25 (1)
Stoich.:	A2B5C15D25 (1)
Weight, g/mol:	307.200825
ΔH_f, kcal/mol:	-32.56
Dipole, Da:	3.81
IP(EA), eV:	-8.88(-0.44)
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-(5-methyl-1,2,4-oxadiazol-3-yl)propan-2-yl]urea

Drug info:

PubChemData

Smile

CC1=NC(=NO1)C(C)(C)NC(=O)NC2CCN(CC2)C3CC3

DOS

IR

Vibrations