Geometry & MOs

Info

ID:	175997
PubChem CID:	75980621
Reduced:	ClO3H15C17 (1)
Stoich.:	AB3C15D17 (1)
Weight, g/mol:	474.114684
ΔH_f, kcal/mol:	-73.28
Dipole, Da:	2.64
IP(EA), eV:	-8.94(-1.09)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[1-(cyclohexylamino)-1-oxopropan-2-yl] 2-[(2,4-dichlorobenzoyl)amino]-4-methylsulfanylbutanoate

Drug info:

PubChemData

Smile

COC1=CC=CC=C1COC(=O)C=CC2=CC=C(C=C2)Cl

DOS

IR

Vibrations