Geometry & MOs

Info

ID:	55620
PubChem CID:	17395684
Reduced:	F3N6H13C16 (1)
Stoich.:	A3B6C13D16 (1)
Weight, g/mol:	292.043712
ΔH_f, kcal/mol:	-22.0
Dipole, Da:	11.68
IP(EA), eV:	-8.98(-1.21)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(4-chlorophenyl)sulfanyl-N-pyridin-2-ylpropanamide

Drug info:

PubChemData

Smile

C1=CC=C2C(=C1)C(=CN2)CCNC3=NN4C(=NN=C4C(F)(F)F)C=C3

DOS

IR

Vibrations