Geometry & MOs

Info

ID:	354647
PubChem CID:	127287264
Reduced:	ClON5C19H30 (1)
Stoich.:	ABC5D19E30 (1)
Weight, g/mol:	345.208613
ΔH_f, kcal/mol:	-35.03
Dipole, Da:	5.58
IP(EA), eV:	-8.68(-0.32)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(1,1-dioxothiolan-3-yl)-1-ethyl-3-[(1-propan-2-ylpiperidin-3-yl)methyl]urea

Drug info:

PubChemData

Smile

CC(C)N1CCCC(C1)CNC(=O)N2CCN(CC2)C3=NC=C(C=C3)Cl

DOS

IR

Vibrations