Geometry & MOs

Info

ID:	135216
PubChem CID:	51835057
Reduced:	N4O5H18C19 (1)
Stoich.:	A4B5C18D19 (1)
Weight, g/mol:	490.210387
ΔH_f, kcal/mol:	-134.88
Dipole, Da:	4.45
IP(EA), eV:	-8.79(-0.58)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(1R)-1-(1,3-benzodioxol-5-yl)-2-(cyclohexylamino)-2-oxoethyl]-2-hydroxy-N-[(5-methylfuran-2-yl)methyl]benzamide

Drug info:

PubChemData

Smile

C1OC2=C(O1)C=C(C=C2)CN3C(=O)[C@H](NC3=O)CC(=O)NCC4=CC=CC=N4

DOS

IR

Vibrations