Geometry & MOs

Info

ID:	156985
PubChem CID:	56404345
Reduced:	NO2C8H13 (2)
Stoich.:	AB2C8D13 (2)
Weight, g/mol:	284.09277
ΔH_f, kcal/mol:	-182.43
Dipole, Da:	3.38
IP(EA), eV:	-9.3(0.86)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(4-chloro-1H-pyrrol-2-yl)-[4-(1,3-dioxolan-2-yl)piperidin-1-yl]methanone

Drug info:

PubChemData

Smile

CC1CC1C(=O)NCCC(=O)N2CCC(CC2)C3OCCO3

DOS

IR

Vibrations