Geometry & MOs

Info

ID:	346351
PubChem CID:	127270855
Reduced:	O2N3C20H21 (1)
Stoich.:	A2B3C20D21 (1)
Weight, g/mol:	386.220557
ΔH_f, kcal/mol:	-11.24
Dipole, Da:	5.52
IP(EA), eV:	-8.71(-0.63)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-cyclopentyl-N-[2-[2-(2,3-dihydro-1,4-benzodioxin-6-yl)pyrrolidin-1-yl]-2-oxoethyl]propanamide

Drug info:

PubChemData

Smile

CC1=CC2=C(C(=C1)C(=O)N3CCCC3C4=CC=C(C=C4)OC)NN=C2

DOS

IR

Vibrations