Geometry & MOs

Info

ID:	17568
PubChem CID:	505077
Reduced:	SN4O4C28H28 (1)
Stoich.:	AB4C4D28E28 (1)
Weight, g/mol:	516.183127
ΔH_f, kcal/mol:	-52.33
Dipole, Da:	7.76
IP(EA), eV:	-9.02(-1.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[3-(dimethylsulfamoyl)phenyl]-3-(4-ethylpyrimidin-2-yl)-N-(naphthalen-2-ylmethyl)-3-oxopropanamide

Drug info:

PubChemData

Smile

CCC1=NC(=NC=C1)C(=O)CC(=O)N(CC2=CC3=CC=CC=C3C=C2)C4=CC(=CC=C4)S(=O)(=O)N(C)C

DOS

IR

Vibrations