Geometry & MOs

Info

ID:	283880
PubChem CID:	104015431
Reduced:	N2C17H28 (1)
Stoich.:	A2B17C28 (1)
Weight, g/mol:	287.145619
ΔH_f, kcal/mol:	-17.3
Dipole, Da:	3.31
IP(EA), eV:	-8.77(0.15)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(3,5-dimethylpyridin-2-yl)-N-ethyl-4,5,6,7-tetrahydro-1,3-benzothiazol-7-amine

Drug info:

PubChemData

Smile

CCCNC(C1CCCCC1)C2=C(C=C(C=N2)C)C

DOS

IR

Vibrations