Geometry & MOs

Info

ID:	58611
PubChem CID:	24712291
Reduced:	ClON3C16H20 (1)
Stoich.:	ABC3D16E20 (1)
Weight, g/mol:	334.179361
ΔH_f, kcal/mol:	-19.13
Dipole, Da:	4.9
IP(EA), eV:	-9.23(-0.83)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-methyl-1-phenyl-3-propyl-N-(pyridin-3-ylmethyl)pyrazole-4-carboxamide

Drug info:

PubChemData

Smile

CC1=C(C(=NN1C2=CC=C(C=C2)Cl)C)C(=O)NCC(C)C

DOS

IR

Vibrations