Geometry & MOs

Info

ID:	250506
PubChem CID:	103097165
Reduced:	FSN2C14H17 (1)
Stoich.:	ABC2D14E17 (1)
Weight, g/mol:	224.13472
ΔH_f, kcal/mol:	-13.12
Dipole, Da:	2.5
IP(EA), eV:	-9.04(-0.41)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-methyl-2-(6-methyl-4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)propan-1-amine

Drug info:

PubChemData

Smile

CC1=C(N=C(S1)C(C)(C)CN)C2=CC=CC=C2F

DOS

IR

Vibrations