Geometry & MOs

Info

ID:	137752
PubChem CID:	52257350
Reduced:	OF3N4C14H15 (1)
Stoich.:	AB3C4D14E15 (1)
Weight, g/mol:	312.054466
ΔH_f, kcal/mol:	-148.23
Dipole, Da:	4.01
IP(EA), eV:	-10.16(-0.71)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(2,6-dichlorophenyl)-N-[(1S)-1-(4-methyl-1,2,4-triazol-3-yl)ethyl]acetamide

Drug info:

PubChemData

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C[C@H](C1=NN=CN1C)NC(=O)CC2=CC(=CC=C2)C(F)(F)F

DOS

IR

Vibrations