Geometry & MOs

Info

ID:	158609
PubChem CID:	56464310
Reduced:	SN2O5C24H30 (1)
Stoich.:	AB2C5D24E30 (1)
Weight, g/mol:	426.1647
ΔH_f, kcal/mol:	-170.89
Dipole, Da:	7.0
IP(EA), eV:	-8.75(-0.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[2-[cyclohexyl(methyl)amino]-2-oxoethyl]sulfanyl-N-(2-ethylsulfonylethyl)benzamide

Drug info:

PubChemData

Smile

CCS(=O)(=O)CCNC(=O)C1CCC(=O)N(C1C2=CC=CC=C2OC)C3=CC=C(C=C3)C

DOS

IR

Vibrations