Geometry & MOs

Info

ID:	350087
PubChem CID:	127276960
Reduced:	O2N4C21H26 (1)
Stoich.:	A2B4C21D26 (1)
Weight, g/mol:	371.224263
ΔH_f, kcal/mol:	-17.12
Dipole, Da:	8.21
IP(EA), eV:	-8.76(-1.0)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(1,1-dioxothiolan-3-yl)-N-ethyl-2-[2-(piperidin-1-ylmethyl)pyrrolidin-1-yl]acetamide

Drug info:

PubChemData

Smile

C1CCN(CC1)CC2CCCN2CC3=NC(=O)C4=C(N3)C5=CC=CC=C5O4

DOS

IR

Vibrations