Geometry & MOs

Info

ID:	345902
PubChem CID:	127270202
Reduced:	FSN3O4C17H22 (1)
Stoich.:	ABC3D4E17F22 (1)
Weight, g/mol:	376.191069
ΔH_f, kcal/mol:	-208.44
Dipole, Da:	7.19
IP(EA), eV:	-9.01(-0.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[1-(1-acetylpiperidine-4-carbonyl)pyrrolidin-3-yl]-3-(4-fluorophenyl)urea

Drug info:

PubChemData

Smile

C1CN(CC1NC(=O)NC2=CC=C(C=C2)F)C(=O)CC3CCS(=O)(=O)C3

DOS

IR

Vibrations