Geometry & MOs

Info

ID:	349840
PubChem CID:	127276232
Reduced:	ON5C13H21 (1)
Stoich.:	AB5C13D21 (1)
Weight, g/mol:	389.213698
ΔH_f, kcal/mol:	3.55
Dipole, Da:	3.25
IP(EA), eV:	-8.59(-0.41)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[4-[1-oxo-1-[2-(piperidin-1-ylmethyl)pyrrolidin-1-yl]propan-2-yl]sulfanylphenyl]acetamide

Drug info:

PubChemData

Smile

C1CCN(CC1)CC2CCCN2C(=O)C3=NNN=C3

DOS

IR

Vibrations