Geometry & MOs

Info

ID:	56091
PubChem CID:	17404338
Reduced:	ClOSN3H12C15 (1)
Stoich.:	ABCD3E12F15 (1)
Weight, g/mol:	373.089641
ΔH_f, kcal/mol:	25.4
Dipole, Da:	4.26
IP(EA), eV:	-9.2(-1.42)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[4-(2-acetamido-4-fluorophenyl)-1,3-thiazol-2-yl]-3-(furan-2-yl)propanamide

Drug info:

PubChemData

Smile

CC1=CN=C(S1)NC(=O)C2=C(N=C3C=CC(=CC3=C2)Cl)C

DOS

IR

Vibrations