Geometry & MOs

Info

ID:	77464
PubChem CID:	49635693
Reduced:	SN3O4C19H31 (1)
Stoich.:	AB3C4D19E31 (1)
Weight, g/mol:	359.212139
ΔH_f, kcal/mol:	-165.63
Dipole, Da:	6.83
IP(EA), eV:	-9.34(0.25)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[1-[(4-fluorophenyl)methyl]piperidin-4-yl]-3-[2-(2-methylimidazol-1-yl)ethyl]urea

Drug info:

PubChemData

Smile

CCS(=O)(=O)N1CCN(CC1)C(=O)NCCCCOCCC2=CC=CC=C2

DOS

IR

Vibrations