Geometry & MOs

Info

ID:	194398
PubChem CID:	78528957
Reduced:	NO4H23C26 (1)
Stoich.:	AB4C23D26 (1)
Weight, g/mol:	406.135114
ΔH_f, kcal/mol:	-78.92
Dipole, Da:	2.55
IP(EA), eV:	-8.85(-0.78)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[1-oxo-1-[(4-phenyl-1,3-thiazol-2-yl)amino]propan-2-yl] 5,6,7,8-tetrahydronaphthalene-2-carboxylate

Drug info:

PubChemData

Smile

CC1=C(OC2=C1C=CC3=CC=CC=C32)C(=O)OC(C4=CC=CC=C4)C(=O)N5CCCC5

DOS

IR

Vibrations