Geometry & MOs

Info

ID:	368330
PubChem CID:	127327923
Reduced:	FSN3O3C18H26 (1)
Stoich.:	ABC3D3E18F26 (1)
Weight, g/mol:	259.14331
ΔH_f, kcal/mol:	-165.73
Dipole, Da:	5.18
IP(EA), eV:	-8.77(-0.15)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2-methyl-1H-imidazol-5-yl)-[3-(1-methylpyrazol-4-yl)pyrrolidin-1-yl]methanone

Drug info:

PubChemData

Smile

CN(CC(=O)NC1CCCN(C1)C2=CC(=CC=C2)F)C3CCS(=O)(=O)C3

DOS

IR

Vibrations