Geometry & MOs

Info

ID:	369923
PubChem CID:	127336769
Reduced:	NO2C7H13 (2)
Stoich.:	AB2C7D13 (2)
Weight, g/mol:	327.252192
ΔH_f, kcal/mol:	-206.17
Dipole, Da:	4.64
IP(EA), eV:	-9.75(1.05)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(1-tert-butylpiperidin-4-yl)-3-[2-hydroxy-2-(oxan-4-yl)ethyl]urea

Drug info:

PubChemData

Smile

C1CC(COC1)CNC(=O)NCC(C2CCOCC2)O

DOS

IR

Vibrations