Geometry & MOs

Info

ID:	355358
PubChem CID:	127288354
Reduced:	ON5C18H25 (1)
Stoich.:	AB5C18D25 (1)
Weight, g/mol:	324.198383
ΔH_f, kcal/mol:	11.89
Dipole, Da:	4.01
IP(EA), eV:	-8.62(-0.61)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(1-tert-butylimidazol-2-yl)sulfanyl-N-(1-ethylpiperidin-3-yl)acetamide

Drug info:

PubChemData

Smile

CCN1CCCC(C1)NC(=O)CC2=C(N(N=N2)C3=CC=CC=C3)C

DOS

IR

Vibrations