Geometry & MOs

Info

ID:	354195
PubChem CID:	127286159
Reduced:	N3O3C22H31 (1)
Stoich.:	A3B3C22D31 (1)
Weight, g/mol:	371.220892
ΔH_f, kcal/mol:	-122.33
Dipole, Da:	3.3
IP(EA), eV:	-8.2(0.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-spiro[1,3-benzodioxole-2,1'-cyclohexane]-5-yl-1,3,4,6,7,8,9,9a-octahydropyrido[1,2-a]pyrazine-2-carboxamide

Drug info:

PubChemData

Smile

C1CCC2(CC1)OC3=C(O2)C=C(C=C3)NC(=O)N4CCCC4CN5CCCC5

DOS

IR

Vibrations