Geometry & MOs

Info

ID:	368254
PubChem CID:	127327807
Reduced:	SO3N5C16H27 (1)
Stoich.:	AB3C5D16E27 (1)
Weight, g/mol:	388.227454
ΔH_f, kcal/mol:	-107.32
Dipole, Da:	6.33
IP(EA), eV:	-9.22(0.41)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[1-(cyclopropanecarbonyl)piperidin-4-yl]-3-[1-(3-fluorophenyl)piperidin-3-yl]urea

Drug info:

PubChemData

Smile

CCS(=O)(=O)N1CCC(CC1)NC(=O)N2CCC(C2)C3=CN(N=C3)C

DOS

IR

Vibrations