Geometry & MOs

Info

ID:	317657
PubChem CID:	126644880
Reduced:	N2F3C16H21 (1)
Stoich.:	A2B3C16D21 (1)
Weight, g/mol:	377.06009
ΔH_f, kcal/mol:	-135.78
Dipole, Da:	4.98
IP(EA), eV:	-8.45(-0.05)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[4-[(6-chloro-1,3-benzothiazol-2-yl)oxy]-2-oxopyridin-1-yl]-N-propan-2-ylacetamide

Drug info:

PubChemData

Smile

CC1(CCC(=NNC2=CC=C(C=C2)C(CF)(F)F)CC1)C

DOS

IR

Vibrations