Geometry & MOs

Info

ID:	354839
PubChem CID:	127287599
Reduced:	O2N4C17H26 (1)
Stoich.:	A2B4C17D26 (1)
Weight, g/mol:	320.221226
ΔH_f, kcal/mol:	-68.72
Dipole, Da:	4.83
IP(EA), eV:	-9.47(-0.4)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalen-2-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)NC2C3CC4CC(C3)CC2C4

DOS

IR

Vibrations