Geometry & MOs

Info

ID:	255941
PubChem CID:	103135780
Reduced:	O2C15H26 (1)
Stoich.:	A2B15C26 (1)
Weight, g/mol:	237.104817
ΔH_f, kcal/mol:	-135.09
Dipole, Da:	4.27
IP(EA), eV:	-9.39(0.71)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(1-methylpyrazol-3-yl)-(4-methylthiadiazol-5-yl)methyl]ethanamine

Drug info:

PubChemData

Smile

CCCC1CCC(=O)C(C1)CC2CCC(O2)C

DOS

IR

Vibrations