Geometry & MOs

Info

ID:	292014
PubChem CID:	114113884
Reduced:	BrSN2C14H19 (1)
Stoich.:	ABC2D14E19 (1)
Weight, g/mol:	254.18167
ΔH_f, kcal/mol:	31.71
Dipole, Da:	3.79
IP(EA), eV:	-8.42(-0.75)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(3-cyclopentylpropyl)-4-ethyl-4-methyl-5H-1,3-thiazol-2-amine

Drug info:

PubChemData

Smile

CC(C)C1(CC1)CNC2=C(C=C(C=C2)Br)C(=S)N

DOS

IR

Vibrations