Geometry & MOs

Info

ID:	358113
PubChem CID:	127295658
Reduced:	ON2C11H16 (2)
Stoich.:	AB2C11D16 (2)
Weight, g/mol:	345.205242
ΔH_f, kcal/mol:	-54.31
Dipole, Da:	5.69
IP(EA), eV:	-9.0(-0.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)-3-piperidin-1-ylpyrrolidine-1-carboxamide

Drug info:

PubChemData

Smile

CC1=CC=CC=C1N2C(=CC(=N2)C(C)(C)C)NC(=O)N(C)CC3CCCOC3

DOS

IR

Vibrations