Geometry & MOs

Info

ID:	134719
PubChem CID:	51744748
Reduced:	N2O5C25H28 (1)
Stoich.:	A2B5C25D28 (1)
Weight, g/mol:	436.199822
ΔH_f, kcal/mol:	-146.93
Dipole, Da:	2.91
IP(EA), eV:	-8.98(-0.77)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(1S)-2-(butylamino)-1-(3-methoxyphenyl)-2-oxoethyl]-N-(furan-2-ylmethyl)-2-hydroxybenzamide

Drug info:

PubChemData

Smile

CCCCNC(=O)[C@@H](C1=CC(=CC=C1)OC)N(CC2=CC=CO2)C(=O)C3=CC=CC=C3O

DOS

IR

Vibrations