Geometry & MOs

Info

ID:	153614
PubChem CID:	56312883
Reduced:	FN2O2C22H25 (1)
Stoich.:	AB2C2D22E25 (1)
Weight, g/mol:	452.0028
ΔH_f, kcal/mol:	-74.23
Dipole, Da:	7.13
IP(EA), eV:	-9.13(-0.4)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[2-(4-bromothiophen-2-yl)-1,3-thiazol-4-yl]-N-[2-(2-fluorophenyl)-2-methylpropyl]acetamide

Drug info:

PubChemData

Smile

CC(C)C(C(=O)NCC(C)(C)C1=CC=CC=C1F)OC2=CC=CC=C2C#N

DOS

IR

Vibrations