Geometry & MOs

Info

ID:	188180
PubChem CID:	77679916
Reduced:	ON5C13H15 (1)
Stoich.:	AB5C13D15 (1)
Weight, g/mol:	481.079837
ΔH_f, kcal/mol:	94.72
Dipole, Da:	4.85
IP(EA), eV:	-9.11(-0.41)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-chloro-4-[[4-(dimethylamino)-6-methylpyrimidin-2-yl]sulfamoyl]phenyl]-3,3,3-trifluoro-2-hydroxy-2-methylpropanamide

Drug info:

PubChemData

Smile

C=CCN1C=NC2C1NN(NC2=O)C3=CC=CC=C3

DOS

IR

Vibrations