Geometry & MOs

Info

ID:	357743
PubChem CID:	127294417
Reduced:	ON5C21H31 (1)
Stoich.:	AB5C21D31 (1)
Weight, g/mol:	359.268511
ΔH_f, kcal/mol:	-10.1
Dipole, Da:	3.59
IP(EA), eV:	-8.86(-0.67)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(1-propylpiperidin-4-yl)-3-[1-(pyridin-2-ylmethyl)piperidin-4-yl]urea

Drug info:

PubChemData

Smile

CCCN1CCC(CC1)NC(=O)N2CCN(CC2)CC3=CC=C(C=C3)C#N

DOS

IR

Vibrations