Geometry & MOs

Info

ID:	219265
PubChem CID:	85098315
Reduced:	IN4O6C29H39 (1)
Stoich.:	AB4C6D29E39 (1)
Weight, g/mol:	667.13484
ΔH_f, kcal/mol:	-223.43
Dipole, Da:	8.0
IP(EA), eV:	-9.32(-1.47)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-oxo-3-phenylmethoxypropyl]-triphenylphosphanium;iodide

Drug info:

PubChemData

Smile

CC(C)CC(C(=O)NN(CC1=CC=C(C=C1)O)C(=O)CI)NC(=O)C(CC(C)C)NC(=O)OCC2=CC=CC=C2

DOS

IR

Vibrations