Geometry & MOs

Info

ID:	349439
PubChem CID:	127275226
Reduced:	N2O3C21H28 (1)
Stoich.:	A2B3C21D28 (1)
Weight, g/mol:	394.189257
ΔH_f, kcal/mol:	-71.58
Dipole, Da:	4.54
IP(EA), eV:	-8.82(-0.03)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[2-(2,3-dihydro-1,4-benzodioxin-5-yl)pyrrolidin-1-yl]-N-(3,4-dihydro-2H-chromen-4-yl)acetamide

Drug info:

PubChemData

Smile

C1CC(N(C1)CC(=O)NC(C2CC2)C3CC3)C4=C5C(=CC=C4)OCCO5

DOS

IR

Vibrations