Geometry & MOs

Info

ID:	360346
PubChem CID:	127300989
Reduced:	SO2N4C19H30 (1)
Stoich.:	AB2C4D19E30 (1)
Weight, g/mol:	384.26376
ΔH_f, kcal/mol:	-87.57
Dipole, Da:	8.08
IP(EA), eV:	-8.8(0.03)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[3-(2-ethylimidazol-1-yl)piperidin-1-yl]-[1-[(1-methylimidazol-2-yl)methyl]piperidin-4-yl]methanone

Drug info:

PubChemData

Smile

CCC1=NC=CN1C2CCCN(C2)C(=O)CSCC(=O)N3CCCCC3

DOS

IR

Vibrations