Geometry & MOs

Info

ID:	290323
PubChem CID:	104429333
Reduced:	SO3N4C13H22 (1)
Stoich.:	AB3C4D13E22 (1)
Weight, g/mol:	301.120861
ΔH_f, kcal/mol:	-121.26
Dipole, Da:	7.81
IP(EA), eV:	-9.2(-0.42)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[(2-aminopyrimidin-5-yl)sulfonylamino]-N-tert-butylpropanamide

Drug info:

PubChemData

Smile

CC(C)(C)NC(=O)CCNS(=O)(=O)C1=CN=C(C=C1)NC

DOS

IR

Vibrations