Geometry & MOs

Info

ID:	343673
PubChem CID:	127266849
Reduced:	SN2O3C17H22 (1)
Stoich.:	AB2C3D17E22 (1)
Weight, g/mol:	337.109627
ΔH_f, kcal/mol:	-86.15
Dipole, Da:	3.55
IP(EA), eV:	-9.87(-0.57)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-methoxy-2-methyl-N-[3-(2-oxopyrimidin-1-yl)propyl]benzenesulfonamide

Drug info:

PubChemData

Smile

CCC1=CC=CC=C1S(=O)(=O)NCC(CC2=CN=CC=C2)CO

DOS

IR

Vibrations