Geometry & MOs

Info

ID:	362329
PubChem CID:	127307358
Reduced:	FO3N4C17H25 (1)
Stoich.:	AB3C4D17E25 (1)
Weight, g/mol:	298.236876
ΔH_f, kcal/mol:	-149.5
Dipole, Da:	2.18
IP(EA), eV:	-8.48(-0.47)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(2-cyclopentyloxyethyl)-3-[(1,4-dimethylpiperazin-2-yl)methyl]urea

Drug info:

PubChemData

Smile

CN1CCN(C(C1)CNC(=O)NCC2=CC(=CC3=C2OCOC3)F)C

DOS

IR

Vibrations