Geometry & MOs

Info

ID:	134865
PubChem CID:	51770644
Reduced:	N2O3C25H42 (1)
Stoich.:	A2B3C25D42 (1)
Weight, g/mol:	492.184956
ΔH_f, kcal/mol:	-185.01
Dipole, Da:	1.84
IP(EA), eV:	-8.98(0.15)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2R)-N-[(1R)-1-(4-chlorophenyl)-2-[(4-methylphenyl)sulfonylmethylamino]-2-oxoethyl]-2-ethyl-N-methylhexanamide

Drug info:

PubChemData

Smile

CCCC[C@@H](CC)C(=O)N(C)[C@@H](C1=CC=C(C=C1)O)C(=O)NC(C)(C)CC(C)(C)C

DOS

IR

Vibrations