Geometry & MOs

Info

ID:	173945
PubChem CID:	75704564
Reduced:	N2O5C26H30 (1)
Stoich.:	A2B5C26D30 (1)
Weight, g/mol:	476.231122
ΔH_f, kcal/mol:	-159.35
Dipole, Da:	1.02
IP(EA), eV:	-9.01(-0.78)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[1-(cyclohexylamino)-1-oxo-3-phenylbutan-2-yl]-N-(furan-2-ylmethyl)-2,3-dihydroxybenzamide

Drug info:

PubChemData

Smile

CC(C1=CC=CC=C1)C(C(=O)NC(C)(C)C)N(CC2=CC=CO2)C(=O)C3=C(C(=CC=C3)O)O

DOS

IR

Vibrations