Geometry & MOs

Info

ID:	204950
PubChem CID:	80035640
Reduced:	NO2F4C14H15 (1)
Stoich.:	AB2C4D14E15 (1)
Weight, g/mol:	228.112344
ΔH_f, kcal/mol:	-275.52
Dipole, Da:	4.09
IP(EA), eV:	-9.57(-1.11)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-imidazol-1-ylethyl)-[1,2,4]triazolo[1,5-a]pyridin-2-amine

Drug info:

PubChemData

Smile

CN(CC1CCCO1)C(=O)C2=C(C=CC(=C2)C(F)(F)F)F

DOS

IR

Vibrations