Geometry & MOs

Info

ID:	154030
PubChem CID:	56313393
Reduced:	FSN2O3C20H29 (1)
Stoich.:	ABC2D3E20F29 (1)
Weight, g/mol:	299.188529
ΔH_f, kcal/mol:	-192.13
Dipole, Da:	3.21
IP(EA), eV:	-9.52(-0.7)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(1,4-dimethylcyclohexyl)-2-(6-methyl-1-benzofuran-3-yl)acetamide

Drug info:

PubChemData

Smile

CC1CCC(CC1)(C)NC(=O)C2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)F

DOS

IR

Vibrations