Geometry & MOs

Info

ID:	173934
PubChem CID:	75702787
Reduced:	N2O5C29H38 (1)
Stoich.:	A2B5C29D38 (1)
Weight, g/mol:	524.325023
ΔH_f, kcal/mol:	-188.36
Dipole, Da:	1.61
IP(EA), eV:	-8.78(-0.2)
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]-3-cyclohexyl-N-(furan-2-ylmethyl)propanamide

Drug info:

PubChemData

Smile

C1CCC(CC1)CCC(=O)N(CC2=CC=CO2)C(C3=CC4=C(C=C3)OCO4)C(=O)NC5CCCCC5

DOS

IR

Vibrations