Geometry & MOs

Info

ID:	362627
PubChem CID:	127308895
Reduced:	ON4C18H24 (1)
Stoich.:	AB4C18D24 (1)
Weight, g/mol:	391.240582
ΔH_f, kcal/mol:	-6.59
Dipole, Da:	4.14
IP(EA), eV:	-8.98(0.52)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(4-methylpyrazol-1-yl)-N-[(1-thiomorpholin-4-ylcyclopentyl)methyl]piperidine-1-carboxamide

Drug info:

PubChemData

Smile

CC1=C(C=NN1C)C(C)NC(=O)NCC2CCC3=CC=CC=C23

DOS

IR

Vibrations