Geometry & MOs

Info

ID:	134814
PubChem CID:	51763035
Reduced:	ClN2O2C21H39 (1)
Stoich.:	AB2C2D21E39 (1)
Weight, g/mol:	546.418529
ΔH_f, kcal/mol:	-172.75
Dipole, Da:	1.92
IP(EA), eV:	-9.54(0.35)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S)-2-cyclohexyl-2-[(2,2-diphenylacetyl)-hexylamino]-N-(2,4,4-trimethylpentan-2-yl)acetamide

Drug info:

PubChemData

Smile

CCCCCCN([C@@H](CCCCC)C(=O)NC1CCCCC1)C(=O)CCl

DOS

IR

Vibrations