Geometry & MOs

Info

ID:	350901
PubChem CID:	127279189
Reduced:	N2O5C22H24 (1)
Stoich.:	A2B5C22D24 (1)
Weight, g/mol:	330.194343
ΔH_f, kcal/mol:	-139.3
Dipole, Da:	3.77
IP(EA), eV:	-8.29(-0.31)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[2-(1,3-benzodioxol-5-yl)pyrrolidin-1-yl]-N-cyclohexylacetamide

Drug info:

PubChemData

Smile

C1CC(N(C1)CC(=O)NC2=CC3=C(C=C2)OCCCO3)C4=CC5=C(C=C4)OCO5

DOS

IR

Vibrations