Geometry & MOs

Info

ID:	131243
PubChem CID:	51180825
Reduced:	NO3C17H25 (1)
Stoich.:	AB3C17D25 (1)
Weight, g/mol:	332.117019
ΔH_f, kcal/mol:	-138.02
Dipole, Da:	5.12
IP(EA), eV:	-8.79(0.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-methylcyclohexyl)-2-[5-(trifluoromethyl)pyridin-2-yl]sulfanylacetamide

Drug info:

PubChemData

Smile

CC1CCCCC1NC(=O)CC2=C(C=C(C=C2)OC)OC

DOS

IR

Vibrations