Geometry & MOs

Info

ID:	142127
PubChem CID:	52986084
Reduced:	NO2C13H17 (1)
Stoich.:	AB2C13D17 (1)
Weight, g/mol:	341.173942
ΔH_f, kcal/mol:	-75.35
Dipole, Da:	4.7
IP(EA), eV:	-8.5(0.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[3-(1,3-benzodioxol-5-yl)pyrazolidin-4-yl]-N-[(3-methoxyphenyl)methyl]methanamine

Drug info:

PubChemData

Smile

CCCC(=O)N1CC(OC2=CC=CC=C21)C

DOS

IR

Vibrations