Geometry & MOs

Info

ID:	358192
PubChem CID:	127295737
Reduced:	ON2C9H16 (2)
Stoich.:	AB2C9D16 (2)
Weight, g/mol:	311.220892
ΔH_f, kcal/mol:	-119.96
Dipole, Da:	4.27
IP(EA), eV:	-8.74(0.92)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-methyl-1-(oxan-3-ylmethyl)-3-(3-oxo-3-piperidin-1-ylpropyl)urea

Drug info:

PubChemData

Smile

C1CCN(CC1)C2CCN(C2)C(=O)NCCC(=O)N3CCCCC3

DOS

IR

Vibrations