Geometry & MOs

Info

ID:	38422
PubChem CID:	8036818
Reduced:	SN4O5C15H18 (1)
Stoich.:	AB4C5D15E18 (1)
Weight, g/mol:	366.099791
ΔH_f, kcal/mol:	-90.65
Dipole, Da:	9.01
IP(EA), eV:	-9.03(-1.07)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-methoxy-5-nitrophenyl)-2-[(5S)-4-oxo-2-(propylamino)-1,3-thiazol-5-yl]acetamide

Drug info:

PubChemData

Smile

CCCNC1=NC(=O)[C@H](S1)CC(=O)NC2=C(C=C(C=C2)OC)[N+](=O)[O-]

DOS

IR

Vibrations