Geometry & MOs

Info

ID:	68607
PubChem CID:	46508751
Reduced:	NSO4C20H21 (1)
Stoich.:	ABC4D20E21 (1)
Weight, g/mol:	394.135114
ΔH_f, kcal/mol:	-73.31
Dipole, Da:	2.47
IP(EA), eV:	-8.32(-0.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(4-methoxyphenoxy)-N-(4-phenyl-1,3-thiazol-2-yl)-N-prop-2-enylpropanamide

Drug info:

PubChemData

Smile

CC(C(=O)N(CC1=CC=CO1)CC2=CC=CS2)OC3=CC=C(C=C3)OC

DOS

IR

Vibrations