Geometry & MOs

Info

ID:	173926
PubChem CID:	75701636
Reduced:	N2O3C29H38 (1)
Stoich.:	A2B3C29D38 (1)
Weight, g/mol:	414.251858
ΔH_f, kcal/mol:	-118.14
Dipole, Da:	2.64
IP(EA), eV:	-8.67(0.05)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[1-(1,3-benzodioxol-5-yl)-2-(cyclohexylamino)-2-oxoethyl]-N-cyclohexylpropanamide

Drug info:

PubChemData

Smile

COC1=CC=C(C=C1)C(C(=O)NC2CCCCC2)N(C3CCCCC3)C(=O)CC4=CC=CC=C4

DOS

IR

Vibrations