Geometry & MOs

Info

ID:	420585
PubChem CID:	135114094
Reduced:	SO3N5C20H31 (1)
Stoich.:	AB3C5D20E31 (1)
Weight, g/mol:	346.156039
ΔH_f, kcal/mol:	-100.94
Dipole, Da:	5.72
IP(EA), eV:	-8.72(-0.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-chloro-N-[2-(2-ethylimidazol-1-yl)ethyl]-4-pyrrolidin-1-ylbenzamide

Drug info:

PubChemData

Smile

C1CCN(CC1)C(=O)C2=CC(=NC=C2)N3CCCN(CC3)S(=O)(=O)N4CCCC4

DOS

IR

Vibrations