Geometry & MOs

Info

ID:	269337
PubChem CID:	103617030
Reduced:	SN3C14H25 (1)
Stoich.:	AB3C14D25 (1)
Weight, g/mol:	419.93296
ΔH_f, kcal/mol:	3.1
Dipole, Da:	4.07
IP(EA), eV:	-8.43(-0.44)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(3,5-dibromo-4-methoxyphenyl)methyl]-2-(2-methyl-1,3-thiazol-4-yl)ethanamine

Drug info:

PubChemData

Smile

CC1=NC=C(S1)CNC2CCN(CC2)CC(C)C

DOS

IR

Vibrations