Geometry & MOs

Info

ID:	237112
PubChem CID:	92717390
Reduced:	ClON3C17H24 (1)
Stoich.:	ABC3D17E24 (1)
Weight, g/mol:	305.190341
ΔH_f, kcal/mol:	-46.53
Dipole, Da:	4.46
IP(EA), eV:	-8.74(-0.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[[(3R)-1-cyclopentylpyrrolidin-3-yl]methyl]-3-(2-fluorophenyl)urea

Drug info:

PubChemData

Smile

C1CCC(C1)N2CC[C@@H](C2)CNC(=O)NC3=CC=C(C=C3)Cl

DOS

IR

Vibrations