Geometry & MOs

Info

ID:	166238
PubChem CID:	74655081
Reduced:	O2F3N4H21C23 (1)
Stoich.:	A2B3C4D21E23 (1)
Weight, g/mol:	445.12269
ΔH_f, kcal/mol:	-117.0
Dipole, Da:	7.18
IP(EA), eV:	-9.03(-1.78)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[5-(4-chlorophenyl)-1,3-oxazol-2-yl]-N-(2-morpholin-4-yl-2-thiophen-2-ylethyl)propanamide

Drug info:

PubChemData

Smile

C1CN(CCN1CC2=CC=C(C=C2)C(F)(F)F)CC3=NC(=O)C4C(=N3)C5=CC=CC=C5O4

DOS

IR

Vibrations