Geometry & MOs

Info

ID:	362322
PubChem CID:	127307351
Reduced:	O2N5C17H33 (1)
Stoich.:	A2B5C17D33 (1)
Weight, g/mol:	360.252526
ΔH_f, kcal/mol:	-114.59
Dipole, Da:	2.98
IP(EA), eV:	-8.31(0.95)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CN1CCN(C(C1)CNC(=O)NCCC(=O)N2CCCCCC2)C

DOS

IR

Vibrations