Geometry & MOs

Info

ID:	174424
PubChem CID:	75761155
Reduced:	NO2C15H19 (2)
Stoich.:	AB2C15D19 (2)
Weight, g/mol:	490.283158
ΔH_f, kcal/mol:	-135.41
Dipole, Da:	3.9
IP(EA), eV:	-8.96(-0.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[1-(1,3-benzodioxol-5-yl)-2-(butylamino)-2-oxoethyl]-2,6,6-trimethyl-N-phenylbicyclo[3.1.1]heptane-3-carboxamide

Drug info:

PubChemData

Smile

CC1C(CC2CC1C2(C)C)C(=O)N(C3=CC=CC=C3)C(C4=CC5=C(C=C4)OCO5)C(=O)NC(C)(C)C

DOS

IR

Vibrations