Geometry & MOs

Info

ID:	371224
PubChem CID:	127344390
Reduced:	FOSN5C20H20 (1)
Stoich.:	ABCD5E20F20 (1)
Weight, g/mol:	386.268176
ΔH_f, kcal/mol:	-7.37
Dipole, Da:	6.35
IP(EA), eV:	-9.22(-1.13)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[(1-benzoylpiperidin-4-yl)methyl]-3-[(1-ethylpiperidin-3-yl)methyl]urea

Drug info:

PubChemData

Smile

C1CC(C2=C(C1)N=C(S2)C3=CC=C(C=C3)F)NC(=O)N4CCN5C=CN=C5C4

DOS

IR

Vibrations