Geometry & MOs

Info

ID:	294676
PubChem CID:	117480798
Reduced:	FO5C15H19 (1)
Stoich.:	AB5C15D19 (1)
Weight, g/mol:	298.149284
ΔH_f, kcal/mol:	-237.72
Dipole, Da:	4.69
IP(EA), eV:	-8.88(-0.47)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[5-[6-(difluoromethyl)-2,3-dihydro-1,4-benzodioxin-7-yl]-1-methylpyrrolidin-3-yl]methanamine

Drug info:

PubChemData

Smile

CC(C)(CC(=O)O)C1=C2C(=CC(=C1OC)F)OCCCO2

DOS

IR

Vibrations