Geometry & MOs

Info

ID:	26008
PubChem CID:	635741
Reduced:	NO3C14H21 (1)
Stoich.:	AB3C14D21 (1)
Weight, g/mol:	576.179811
ΔH_f, kcal/mol:	-149.96
Dipole, Da:	2.92
IP(EA), eV:	-8.71(-0.21)
Spin(S_z, S²):	None, None
Charge, e:	-6

Chem-info

IUPAC name:

butane;cyclopentane;2-diphenylphosphanylethyl(diphenyl)phosphane;iron

Drug info:

PubChemData

Smile

CC1(CC(=O)NC1=CC2=CC(C(O2)(C)O)(C)C)C

DOS

IR

Vibrations