Geometry & MOs

Info

ID:	365560
PubChem CID:	127318034
Reduced:	SO2N4C19H32 (1)
Stoich.:	AB2C4D19E32 (1)
Weight, g/mol:	297.241627
ΔH_f, kcal/mol:	-86.09
Dipole, Da:	3.8
IP(EA), eV:	-8.66(-0.41)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[(3-methyloxolan-3-yl)methyl]-3-[(1-propan-2-ylpiperidin-3-yl)methyl]urea

Drug info:

PubChemData

Smile

CCC1=CSC(=N1)C2CCCN(C2)C(=O)NCCN3CCOCC3(C)C

DOS

IR

Vibrations