Geometry & MOs

Info

ID:	178908
PubChem CID:	76400251
Reduced:	FO3N4C19H23 (1)
Stoich.:	AB3C4D19E23 (1)
Weight, g/mol:	383.212139
ΔH_f, kcal/mol:	-129.16
Dipole, Da:	3.76
IP(EA), eV:	-9.21(-0.25)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-[3-(3-fluorophenyl)-1,2,3,3a,4,6,7,7a-octahydropyrazolo[4,3-c]pyridin-5-yl]-N-propylpyridine-3-carboxamide

Drug info:

PubChemData

Smile

CC1=C(C(=NN1)C)CNC(=O)C2CC(N(C2C3=CC=CC=C3F)C)C(=O)O

DOS

IR

Vibrations