Geometry & MOs

Info

ID:	154370
PubChem CID:	56313789
Reduced:	FN2O4C23H25 (1)
Stoich.:	AB2C4D23E25 (1)
Weight, g/mol:	416.11254
ΔH_f, kcal/mol:	-170.3
Dipole, Da:	3.29
IP(EA), eV:	-9.76(-1.61)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC(C)(CNC(=O)C1=CC2=C(C=C1)C(=O)N(C2=O)CCCOC)C3=CC=CC=C3F

DOS

IR

Vibrations