Geometry & MOs

Info

ID:	148530
PubChem CID:	53788193
Reduced:	NOC22H33 (1)
Stoich.:	ABC22D33 (1)
Weight, g/mol:	205.95133
ΔH_f, kcal/mol:	-45.27
Dipole, Da:	2.44
IP(EA), eV:	-8.38(0.73)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-(2-bromoethyl)-1,3-thiazol-2-amine

Drug info:

PubChemData

Smile

CC1=C(C2=C(C[C@@H]3C4([C@]2(CCN3C)C([C@@H](CC4)O)(C)C)C)C=C1)C

DOS

IR

Vibrations