Geometry & MOs

Info

ID:	343694
PubChem CID:	127266870
Reduced:	ClON4C13H17 (1)
Stoich.:	ABC4D13E17 (1)
Weight, g/mol:	340.13176
ΔH_f, kcal/mol:	-19.63
Dipole, Da:	2.25
IP(EA), eV:	-9.19(-0.67)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-ethyl-N-[3-[(6-methoxypyrimidin-4-yl)amino]propyl]pyrazole-4-sulfonamide

Drug info:

PubChemData

Smile

CCNC(=O)N(C)C(C)C1=NC2=C(N1)C=C(C=C2)Cl

DOS

IR

Vibrations