Geometry & MOs

Info

ID:	367419
PubChem CID:	127324581
Reduced:	ON5C20H27 (1)
Stoich.:	AB5C20D27 (1)
Weight, g/mol:	357.205242
ΔH_f, kcal/mol:	3.35
Dipole, Da:	3.74
IP(EA), eV:	-8.55(0.05)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(1-cyclopropylpyrrolidin-3-yl)-2-(2,3-dihydro-1,4-benzodioxin-5-yl)pyrrolidine-1-carboxamide

Drug info:

PubChemData

Smile

CC1=CC2=C(C=C1)N=C(N2)C3CCCN3C(=O)NC4CCN(C4)C5CC5

DOS

IR

Vibrations