Geometry & MOs

Info

ID:	179401
PubChem CID:	76477659
Reduced:	N3O5C26H29 (1)
Stoich.:	A3B5C26D29 (1)
Weight, g/mol:	426.361014
ΔH_f, kcal/mol:	-167.66
Dipole, Da:	2.58
IP(EA), eV:	-8.96(-0.54)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N'-(2,3-dihydro-1H-inden-1-yl)-8-(2-octylcyclopropyl)octanehydrazide

Drug info:

PubChemData

Smile

COC(=O)C(CCCNC(=O)OCC1=CC=CC=C1)NC(=O)NCC2=CC3=CC=CC=C3C=C2

DOS

IR

Vibrations