Geometry & MOs

Info

ID:	245240
PubChem CID:	99438001
Reduced:	FO3N5C19H26 (1)
Stoich.:	AB3C5D19E26 (1)
Weight, g/mol:	387.207053
ΔH_f, kcal/mol:	-149.63
Dipole, Da:	7.52
IP(EA), eV:	-9.04(-0.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(3-fluorophenyl)-3-[[(3S)-1-(1,3,5-trimethylpyrazole-4-carbonyl)piperidin-3-yl]methyl]urea

Drug info:

PubChemData

Smile

C1C[C@@H](CN(C1)C(=O)CNC(=O)NC2CC2)CNC(=O)NC3=CC(=CC=C3)F

DOS

IR

Vibrations