Geometry & MOs

Info

ID:	131522
PubChem CID:	51220961
Reduced:	OSN3C17H17 (1)
Stoich.:	ABC3D17E17 (1)
Weight, g/mol:	388.202989
ΔH_f, kcal/mol:	41.71
Dipole, Da:	3.13
IP(EA), eV:	-8.86(-0.98)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-benzyl-5-chloro-3-methyl-N-[3-(2-methylpiperidin-1-yl)propyl]pyrazole-4-carboxamide

Drug info:

PubChemData

Smile

CCN1C2=CC=CC=C2N=C1CNC(=O)/C=C/C3=CSC=C3

DOS

IR

Vibrations