Geometry & MOs

Info

ID:	289964
PubChem CID:	104392024
Reduced:	ClN3O4C13H14 (1)
Stoich.:	AB3C4D13E14 (1)
Weight, g/mol:	304.039689
ΔH_f, kcal/mol:	-60.45
Dipole, Da:	3.5
IP(EA), eV:	-9.82(-2.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(2-chloropyrimidin-5-yl)sulfonylamino]-N-cyclopropylpropanamide

Drug info:

PubChemData

Smile

CC(C(=O)NC1CC1)NC(=O)C2=CC(=C(C=C2)[N+](=O)[O-])Cl

DOS

IR

Vibrations