Geometry & MOs

Info

ID:	173834
PubChem CID:	75689739
Reduced:	F2N2O2C23H26 (1)
Stoich.:	A2B2C2D23E26 (1)
Weight, g/mol:	391.135448
ΔH_f, kcal/mol:	-131.55
Dipole, Da:	2.32
IP(EA), eV:	-8.84(-0.39)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[1-(azetidin-1-yl)-1-oxo-3-phenylpropan-2-yl]-3-(1,2-thiazol-5-yl)benzamide

Drug info:

PubChemData

Smile

C1CC(C1)(C2=CC(=CC=C2)F)C(=O)NCC(C3=CC=C(C=C3)F)N4CCOCC4

DOS

IR

Vibrations