Geometry & MOs

Info

ID:	448652
PubChem CID:	135292500
Reduced:	O4N5C10H15 (1)
Stoich.:	A4B5C10D15 (1)
Weight, g/mol:	467.175594
ΔH_f, kcal/mol:	-92.65
Dipole, Da:	3.65
IP(EA), eV:	-9.33(-0.77)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N'-[(Z)-3-[5-[3,5-bis(trifluoromethyl)phenyl]-1,3-dihydro-1,2,4-triazol-2-yl]-1-methoxyprop-2-enyl]-3-methylbutanehydrazide

Drug info:

PubChemData

Smile

C=NN/C=C\C(=O)NNC(=O)C(=O)N1CCOCC1

DOS

IR

Vibrations