Geometry & MOs

Info

ID:	292016
PubChem CID:	114137360
Reduced:	ClOSN3C13H14 (1)
Stoich.:	ABCD3E13F14 (1)
Weight, g/mol:	254.18167
ΔH_f, kcal/mol:	2.41
Dipole, Da:	3.53
IP(EA), eV:	-9.32(-1.03)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(3-cyclopentylpropyl)-4,4-dimethyl-5,6-dihydro-1,3-thiazin-2-amine

Drug info:

PubChemData

Smile

CCC1=CC=C(S1)CNC2=C(C(=NC(=N2)C)Cl)C=O

DOS

IR

Vibrations