Geometry & MOs

Info

ID:	445276
PubChem CID:	135265749
Reduced:	NO2C7H13 (1)
Stoich.:	AB2C7D13 (1)
Weight, g/mol:	299.13578
ΔH_f, kcal/mol:	-84.5
Dipole, Da:	2.21
IP(EA), eV:	-8.96(0.6)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N'-ethyl-N'-[5-[5-(trifluoromethyl)-1H-imidazol-2-yl]pyridin-2-yl]ethane-1,2-diamine

Drug info:

PubChemData

Smile

C/C=C(/CC(O)O)\N=CC

DOS

IR

Vibrations