Geometry & MOs

Info

ID:	271917
PubChem CID:	103699847
Reduced:	NO2F3C15H20 (1)
Stoich.:	AB2C3D15E20 (1)
Weight, g/mol:	273.129969
ΔH_f, kcal/mol:	-250.88
Dipole, Da:	2.95
IP(EA), eV:	-9.33(-0.37)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-cyclopropyl-N-[(2-pyridin-2-yl-1,3-thiazol-4-yl)methyl]propan-2-amine

Drug info:

PubChemData

Smile

C1CC(CC(C1)O)CNCC2=CC(=CC=C2)OC(F)(F)F

DOS

IR

Vibrations