Geometry & MOs

Info

ID:	322723
PubChem CID:	126670905
Reduced:	PN3O8C21H24 (1)
Stoich.:	AB3C8D21E24 (1)
Weight, g/mol:	435.032379
ΔH_f, kcal/mol:	-326.26
Dipole, Da:	2.85
IP(EA), eV:	-9.15(-1.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[4-[[2-acetylimino-4-methyl-5-(methylsulfamoyl)-1,3-thiazol-3-yl]methyl]phenyl] dihydrogen phosphate

Drug info:

PubChemData

Smile

CC(C)NC(=O)C1=NC2=CC=CC=C2N=C1OCC3=C(C=C(C=C3OC)OP(=O)(O)O)OC

DOS

IR

Vibrations