Geometry & MOs

Info

ID:	172503
PubChem CID:	75517112
Reduced:	FNOH6C7 (2)
Stoich.:	ABCD6E7 (2)
Weight, g/mol:	285.15896
ΔH_f, kcal/mol:	-124.28
Dipole, Da:	2.67
IP(EA), eV:	-9.79(-0.72)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-phenyl-2-[4-(triazol-1-yl)piperidin-1-yl]acetamide

Drug info:

PubChemData

Smile

C1=CC(=C(C(=C1)F)CC(=O)NC2=C(C=CN=C2)CO)F

DOS

IR

Vibrations