Geometry & MOs

Info

ID:	237108
PubChem CID:	92717374
Reduced:	ON3C19H29 (1)
Stoich.:	AB3C19D29 (1)
Weight, g/mol:	301.215413
ΔH_f, kcal/mol:	-58.52
Dipole, Da:	2.79
IP(EA), eV:	-8.64(0.35)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[[(3S)-1-cyclopentylpyrrolidin-3-yl]methyl]-3-(4-methylphenyl)urea

Drug info:

PubChemData

Smile

CC1=CC(=CC(=C1)NC(=O)NC[C@H]2CCN(C2)C3CCCC3)C

DOS

IR

Vibrations