Geometry & MOs

Info

ID:	200825
PubChem CID:	79449388
Reduced:	BrNOC16H26 (1)
Stoich.:	ABCD16E26 (1)
Weight, g/mol:	354.04015
ΔH_f, kcal/mol:	-46.47
Dipole, Da:	2.08
IP(EA), eV:	-9.02(-0.13)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(2-bromophenyl)-N-(2-methoxyethyl)-3-(1,3-thiazol-4-yl)propan-1-amine

Drug info:

PubChemData

Smile

CC(C)CCC(CNCCOC)C1=CC=CC=C1Br

DOS

IR

Vibrations