Geometry & MOs

Info

ID:	206197
PubChem CID:	80217997
Reduced:	N3C18H31 (1)
Stoich.:	A3B18C31 (1)
Weight, g/mol:	357.00343
ΔH_f, kcal/mol:	-13.76
Dipole, Da:	1.66
IP(EA), eV:	-8.35(0.42)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(5-bromofuran-2-yl)-(3-methylsulfonylphenyl)methyl]ethanamine

Drug info:

PubChemData

Smile

CCCNC1=CC=CC(=N1)CN(C)C2CCC(CC2)(C)C

DOS

IR

Vibrations