Geometry & MOs

Info

ID:	29710
PubChem CID:	836666
Reduced:	NOS2C13H13 (1)
Stoich.:	ABC2D13E13 (1)
Weight, g/mol:	266.066697
ΔH_f, kcal/mol:	4.09
Dipole, Da:	2.75
IP(EA), eV:	-8.58(-0.49)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-pyridin-2-yl-4-(trifluoromethyl)benzamide

Drug info:

PubChemData

Smile

CSC1=CC=CC(=C1)NC(=O)CC2=CC=CS2

DOS

IR

Vibrations