Geometry & MOs

Info

ID:	443811
PubChem CID:	135260045
Reduced:	N5H9C10 (1)
Stoich.:	A5B9C10 (1)
Weight, g/mol:	240.082267
ΔH_f, kcal/mol:	120.05
Dipole, Da:	2.4
IP(EA), eV:	-9.09(-1.0)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(3,5-difluoro-4-methoxyphenyl)methyl]triazol-4-amine

Drug info:

PubChemData

Smile

C1=CC(=CC=C1CN2N=CC(=N2)N)C#N

DOS

IR

Vibrations