Geometry & MOs

Info

ID:	232311
PubChem CID:	87575958
Reduced:	SN5O9C36H49 (1)
Stoich.:	AB5C9D36E49 (1)
Weight, g/mol:	230.024157
ΔH_f, kcal/mol:	-352.25
Dipole, Da:	15.96
IP(EA), eV:	-9.68(-0.31)
Spin(S_z, S²):	None, None
Charge, e:	-6

Chem-info

IUPAC name:

1-cyclopenta-2,4-dien-1-ylethanone;cyclopentane;nickel

Drug info:

PubChemData

Smile

CC1(CC1)S(=O)(=O)NC(=O)C23CC2/C=C/CCCCCC(C(=O)N4CC(CC4C(=O)N3)OC(=O)N5CC6=CC=CC=C6C5)NC(=O)OC(C)(C)C

DOS

IR

Vibrations