Geometry & MOs

Info

ID:	345564
PubChem CID:	127269864
Reduced:	O2N5C19H29 (1)
Stoich.:	A2B5C19D29 (1)
Weight, g/mol:	363.207053
ΔH_f, kcal/mol:	-69.01
Dipole, Da:	3.94
IP(EA), eV:	-8.22(0.43)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[2-[4-(4-fluorophenyl)piperazin-1-yl]ethyl]-3-(2-oxopiperidin-3-yl)urea

Drug info:

PubChemData

Smile

CC(CNC(=O)NC1CCCNC1=O)N2CCN(CC2)C3=CC=CC=C3

DOS

IR

Vibrations