Geometry & MOs

Info

ID:	372406
PubChem CID:	131297146
Reduced:	NOH7C10 (1)
Stoich.:	ABC7D10 (1)
Weight, g/mol:	157.010996
ΔH_f, kcal/mol:	49.06
Dipole, Da:	5.22
IP(EA), eV:	-9.35(-0.27)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(2-amino-1,3-thiazol-4-yl)-2-fluoroacetonitrile

Drug info:

PubChemData

Smile

C1=CC(=CC=C1CC#CC#N)O

DOS

IR

Vibrations