Geometry & MOs

Info

ID:	244298
PubChem CID:	99319729
Reduced:	FOSN4H23C25 (1)
Stoich.:	ABCD4E23F25 (1)
Weight, g/mol:	368.221226
ΔH_f, kcal/mol:	22.5
Dipole, Da:	3.45
IP(EA), eV:	-8.89(-0.9)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2R)-2-acetamido-2-cyclopentyl-N-[(1S)-1-(5-methyl-1-phenylpyrazol-4-yl)ethyl]acetamide

Drug info:

PubChemData

Smile

CC1=C(C=NN1C2=CC=CC=C2)[C@@H](C)NC(=O)C3=C(N=CC=C3)SCC4=CC=C(C=C4)F

DOS

IR

Vibrations