Geometry & MOs

Info

ID:	173950
PubChem CID:	75704569
Reduced:	N2O6C31H32 (1)
Stoich.:	A2B6C31D32 (1)
Weight, g/mol:	502.210387
ΔH_f, kcal/mol:	-166.57
Dipole, Da:	7.63
IP(EA), eV:	-8.68(-0.86)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(butylamino)-1-(2-methoxynaphthalen-1-yl)-2-oxoethyl]-N-(furan-2-ylmethyl)-2,3-dihydroxybenzamide

Drug info:

PubChemData

Smile

COC1=C(C2=CC=CC=C2C=C1)C(C(=O)NC3CCCCC3)N(CC4=CC=CO4)C(=O)C5=C(C(=CC=C5)O)O

DOS

IR

Vibrations