Geometry & MOs

Info

ID:	145842
PubChem CID:	53600851
Reduced:	ClSN3O4H10C12 (1)
Stoich.:	ABC3D4E10F12 (1)
Weight, g/mol:	271.14331
ΔH_f, kcal/mol:	-25.96
Dipole, Da:	1.25
IP(EA), eV:	-9.28(-2.19)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-cyclopropyl-N-ethyl-2-(2-pyrazin-2-ylimidazol-1-yl)acetamide

Drug info:

PubChemData

Smile

CN(C1=NC=C(C=C1)Cl)S(=O)(=O)C2=CC=C(C=C2)[N+](=O)[O-]

DOS

IR

Vibrations