Geometry & MOs

Info

ID:	162219
PubChem CID:	57393973
Reduced:	FOSN3H16C19 (1)
Stoich.:	ABCD3E16F19 (1)
Weight, g/mol:	365.119798
ΔH_f, kcal/mol:	12.09
Dipole, Da:	8.02
IP(EA), eV:	-9.11(-1.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[5-(4-methoxyphenyl)-3-(4-methylphenyl)-3,4-dihydropyrazol-2-yl]-1,3-thiazol-4-one

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)C2=NN(C(C2)C3=CC=C(C=C3)F)C4=NC(=O)CS4

DOS

IR

Vibrations