Geometry & MOs

Info

ID:	224565
PubChem CID:	85344854
Reduced:	OC3H6 (4)
Stoich.:	AB3C6 (4)
Weight, g/mol:	231.96698
ΔH_f, kcal/mol:	-216.58
Dipole, Da:	3.84
IP(EA), eV:	-9.85(1.53)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[4-(2-bromoethenyl)-1,3-thiazol-2-yl]ethanamine

Drug info:

PubChemData

Smile

CCC1(OCCO1)C(C)CC(C)C(CO)O

DOS

IR

Vibrations