Geometry & MOs

Info

ID:	251876
PubChem CID:	103107519
Reduced:	FON2C15H23 (1)
Stoich.:	ABC2D15E23 (1)
Weight, g/mol:	241.081104
ΔH_f, kcal/mol:	-86.66
Dipole, Da:	6.39
IP(EA), eV:	-9.29(0.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 1-[2-(2-acetylhydrazinyl)-2-oxoethyl]triazole-4-carboxylate

Drug info:

PubChemData

Smile

CCC(C1=CC(=CC=C1)F)NC(C)C(=O)N(C)CC

DOS

IR

Vibrations