Geometry & MOs

Info

ID:	335704
PubChem CID:	127254566
Reduced:	SO2N7C19H21 (1)
Stoich.:	AB2C7D19E21 (1)
Weight, g/mol:	496.123898
ΔH_f, kcal/mol:	67.02
Dipole, Da:	7.13
IP(EA), eV:	-8.08(-0.85)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-amino-1-[3-(1,1-dioxothiazinan-2-yl)-4-methoxyphenyl]-4-(4-phenyl-1,3-thiazol-2-yl)-2H-pyrrol-3-one

Drug info:

PubChemData

Smile

CC[C@H](C)[C@@H](C(=O)NC1=NC(=CS1)C2=CNC3=C2C=C(C=C3)OC)N4C=NN=N4

DOS

IR

Vibrations