Geometry & MOs

Info

ID:	231226
PubChem CID:	87573070
Reduced:	SiO5C13H28 (1)
Stoich.:	AB5C13D28 (1)
Weight, g/mol:	389.150619
ΔH_f, kcal/mol:	-336.99
Dipole, Da:	6.13
IP(EA), eV:	-9.78(0.15)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[1-[1-[(6-chloro-5-pyridin-4-ylpyridin-3-yl)oxymethyl]cyclopropyl]-2,2-dimethylpropyl]carbamic acid

Drug info:

PubChemData

Smile

CCC[Si](OCC)(OCC)OCC.CC(=C)C(=O)O

DOS

IR

Vibrations