Geometry & MOs

Info

ID:	174407
PubChem CID:	75761138
Reduced:	NOC14H20 (2)
Stoich.:	ABC14D20 (2)
Weight, g/mol:	466.355929
ΔH_f, kcal/mol:	-88.3
Dipole, Da:	3.08
IP(EA), eV:	-9.52(-0.03)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,6,6-trimethyl-N-[1-oxo-1-(2,4,4-trimethylpentan-2-ylamino)pent-3-en-2-yl]-N-phenylbicyclo[3.1.1]heptane-3-carboxamide

Drug info:

PubChemData

Smile

CC=CC(C(=O)NC1CCCCC1)N(C2=CC=CC=C2)C(=O)C3CC4CC(C3C)C4(C)C

DOS

IR

Vibrations