Geometry & MOs

Info

ID:	289910
PubChem CID:	104386120
Reduced:	SO3N4C13H20 (1)
Stoich.:	AB3C4D13E20 (1)
Weight, g/mol:	311.151288
ΔH_f, kcal/mol:	-98.91
Dipole, Da:	6.56
IP(EA), eV:	-9.35(-0.82)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[5-(1-chloroethyl)-1,3-dimethylimidazo[4,5-c]pyrazol-6-yl]-N,N-diethylacetamide

Drug info:

PubChemData

Smile

CCC1=NN=C(N1CC(=O)N2CCCCC2)SCC(=O)O

DOS

IR

Vibrations