Geometry & MOs

Info

ID:	371713
PubChem CID:	131270920
Reduced:	ON2C8H14 (1)
Stoich.:	AB2C8D14 (1)
Weight, g/mol:	180.046967
ΔH_f, kcal/mol:	-28.88
Dipole, Da:	6.4
IP(EA), eV:	-9.45(1.0)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[5-(1H-pyrazol-5-yl)-1,2-thiazol-4-yl]methanamine

Drug info:

PubChemData

Smile

C1CCN([C@H](C1)CO)CC#N

DOS

IR

Vibrations