Geometry & MOs

Info

ID:	173951
PubChem CID:	75704570
Reduced:	N2O6C29H30 (1)
Stoich.:	A2B6C29D30 (1)
Weight, g/mol:	490.246772
ΔH_f, kcal/mol:	-160.58
Dipole, Da:	4.65
IP(EA), eV:	-8.61(-0.79)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[1-(1,3-benzodioxol-5-yl)-2-oxo-2-(2,4,4-trimethylpentan-2-ylamino)ethyl]-N-(furan-2-ylmethyl)benzamide

Drug info:

PubChemData

Smile

CCCCNC(=O)C(C1=C(C=CC2=CC=CC=C21)OC)N(CC3=CC=CO3)C(=O)C4=C(C(=CC=C4)O)O

DOS

IR

Vibrations