Geometry & MOs

Info

ID:	154878
PubChem CID:	56314423
Reduced:	BrFNO2C16H17 (1)
Stoich.:	ABCD2E16F17 (1)
Weight, g/mol:	382.151513
ΔH_f, kcal/mol:	-87.97
Dipole, Da:	1.43
IP(EA), eV:	-9.46(-0.86)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC1=C(OC(=C1)Br)C(=O)NCC(C)(C)C2=CC=CC=C2F

DOS

IR

Vibrations