Geometry & MOs

Info

ID:	365344
PubChem CID:	127317743
Reduced:	N3O3C20H27 (1)
Stoich.:	A3B3C20D27 (1)
Weight, g/mol:	393.168856
ΔH_f, kcal/mol:	-96.03
Dipole, Da:	2.71
IP(EA), eV:	-8.28(0.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(1-acetyl-2,3-dihydroindol-5-yl)-3-spiro[1,3-benzodioxole-2,1'-cyclopentane]-5-ylurea

Drug info:

PubChemData

Smile

C1CCC2(C1)OC3=C(O2)C=C(C=C3)NC(=O)N4CCN(CC4)C5CCC5

DOS

IR

Vibrations