Geometry & MOs

Info

ID:	156504
PubChem CID:	56370906
Reduced:	FOSN4C20H23 (1)
Stoich.:	ABCD4E20F23 (1)
Weight, g/mol:	415.150053
ΔH_f, kcal/mol:	-16.07
Dipole, Da:	4.93
IP(EA), eV:	-8.86(-0.73)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(4-methyl-5-propan-2-yl-1,2,4-triazol-3-yl)sulfanyl]-N-[4-(2,4,5-trimethylphenyl)-1,3-thiazol-2-yl]acetamide

Drug info:

PubChemData

Smile

CC1=CC(=C(N1C2=CC(=CC=C2)F)C)C(=O)CSC3=NN=C(N3C)C(C)C

DOS

IR

Vibrations