Geometry & MOs

Info

ID:	197112
PubChem CID:	78923852
Reduced:	ON5C15H21 (1)
Stoich.:	AB5C15D21 (1)
Weight, g/mol:	268.084576
ΔH_f, kcal/mol:	1.11
Dipole, Da:	1.67
IP(EA), eV:	-8.56(-0.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(2,5-difluorophenyl)-(1,3-thiazol-4-yl)methyl]propan-1-amine

Drug info:

PubChemData

Smile

CC1=NC(=NN1)C2=CC(=CC=C2)NC(=O)CNC(C)(C)C

DOS

IR

Vibrations