Geometry & MOs

Info

ID:	360349
PubChem CID:	127300992
Reduced:	O2N7C18H23 (1)
Stoich.:	A2B7C18D23 (1)
Weight, g/mol:	368.188212
ΔH_f, kcal/mol:	-3.27
Dipole, Da:	3.91
IP(EA), eV:	-8.91(-0.79)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(1,1-dioxothiolan-3-yl)-methylamino]-1-[3-(2-ethylimidazol-1-yl)piperidin-1-yl]ethanone

Drug info:

PubChemData

Smile

CCC1=NC=CN1C2CCCN(C2)C(=O)CN3C=NC4=C(C3=O)C=NN4C

DOS

IR

Vibrations