Geometry & MOs

Info

ID:	265793
PubChem CID:	103546496
Reduced:	NSO4C12H25 (1)
Stoich.:	ABC4D12E25 (1)
Weight, g/mol:	345.07397
ΔH_f, kcal/mol:	-203.23
Dipole, Da:	3.53
IP(EA), eV:	-9.08(0.96)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(2-bromo-4-fluorophenyl)-3-(1,3-dioxolan-2-yl)-N-propylpropan-2-amine

Drug info:

PubChemData

Smile

CCCNC(CCCS(=O)(=O)C)CC1OCCO1

DOS

IR

Vibrations