Geometry & MOs

Info

ID:	202995
PubChem CID:	79759048
Reduced:	ClFNSO4C12H13 (1)
Stoich.:	ABCDE4F12G13 (1)
Weight, g/mol:	341.09904
ΔH_f, kcal/mol:	-208.62
Dipole, Da:	8.79
IP(EA), eV:	-10.28(-1.45)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(3-bromo-4-methoxyphenyl)-(2-methyloxolan-3-yl)methyl]propan-1-amine

Drug info:

PubChemData

Smile

CC1C(CCO1)C(=O)NC2=CC(=C(C=C2)S(=O)(=O)Cl)F

DOS

IR

Vibrations