Geometry & MOs

Info

ID:	200492
PubChem CID:	79398814
Reduced:	BrSN3C10H16 (1)
Stoich.:	ABC3D10E16 (1)
Weight, g/mol:	261.97755
ΔH_f, kcal/mol:	20.76
Dipole, Da:	3.69
IP(EA), eV:	-8.48(-0.53)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-bromo-N-(oxolan-2-ylmethyl)-1,3-thiazol-2-amine

Drug info:

PubChemData

Smile

CC1(CN(CCN1C)C2=NC(=CS2)Br)C

DOS

IR

Vibrations