Geometry & MOs

Info

ID:	269902
PubChem CID:	103619610
Reduced:	O2N4C11H18 (1)
Stoich.:	A2B4C11D18 (1)
Weight, g/mol:	198.111676
ΔH_f, kcal/mol:	-47.32
Dipole, Da:	5.5
IP(EA), eV:	-9.68(-0.53)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]-3-propan-2-ylurea

Drug info:

PubChemData

Smile

CC1=NC(=NO1)CNC(=O)NC2CCCCC2

DOS

IR

Vibrations