Geometry & MOs

Info

ID:	346125
PubChem CID:	127270613
Reduced:	O3N4C19H28 (1)
Stoich.:	A3B4C19D28 (1)
Weight, g/mol:	268.189926
ΔH_f, kcal/mol:	-111.2
Dipole, Da:	6.84
IP(EA), eV:	-8.8(-0.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[2-[cyclopropyl(ethyl)amino]ethyl]-3-(2-oxopiperidin-3-yl)urea

Drug info:

PubChemData

Smile

CC(=O)N1CCN(CC1)C2=CC=CC=C2CNC(=O)N3CCCOCC3

DOS

IR

Vibrations