Geometry & MOs

Info

ID:	379146
PubChem CID:	134354929
Reduced:	O4N6C17H22 (1)
Stoich.:	A4B6C17D22 (1)
Weight, g/mol:	346.109962
ΔH_f, kcal/mol:	-79.16
Dipole, Da:	4.57
IP(EA), eV:	-8.45(-0.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2-[(5-methyl-1,3-thiazol-2-yl)carbamoyl]phenyl] piperazine-1-carboxylate

Drug info:

PubChemData

Smile

COC1=CC=CC=C1NC(=O)N[C@@H](CC(=O)N)C2=NC(=NO2)N3CCCC3

DOS

IR

Vibrations