Geometry & MOs

Info

ID:	174150
PubChem CID:	75730911
Reduced:	N2O3C23H36 (1)
Stoich.:	A2B3C23D36 (1)
Weight, g/mol:	478.142613
ΔH_f, kcal/mol:	-167.77
Dipole, Da:	3.27
IP(EA), eV:	-9.42(-0.32)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(cyclohexylamino)-1-(2,6-dichlorophenyl)-2-oxoethyl]-2,3-dihydroxy-N-propylbenzamide

Drug info:

PubChemData

Smile

CCCCCC(C(=O)NC1CCCCC1)N(CCC)C(=O)C2=CC=C(C=C2)O

DOS

IR

Vibrations