Geometry & MOs

Info

ID:	146126
PubChem CID:	53640065
Reduced:	SO2N3C15H21 (1)
Stoich.:	AB2C3D15E21 (1)
Weight, g/mol:	279.137162
ΔH_f, kcal/mol:	-42.22
Dipole, Da:	4.21
IP(EA), eV:	-9.76(-1.44)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(3-methoxy-5-methylphenyl)-5-methyl-4-pyrazol-1-ylpyridine

Drug info:

PubChemData

Smile

CC=CC(=O)C(C1CCCCC1)NC(=O)C2=C(N=NS2)C

DOS

IR

Vibrations