Geometry & MOs

Info

ID:	231256
PubChem CID:	87573228
Reduced:	Si3O7C17H36 (1)
Stoich.:	A3B7C17D36 (1)
Weight, g/mol:	460.054388
ΔH_f, kcal/mol:	-509.74
Dipole, Da:	8.84
IP(EA), eV:	-9.63(-0.43)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[1-[[5-[3,5-bis(trifluoromethyl)phenyl]-6-chloropyridin-3-yl]oxymethyl]cyclopropyl]methanamine;hydrochloride

Drug info:

PubChemData

Smile

CCC(/C(=C(\C)/C(=O)O)/C(=O)C(CO)O)[Si](C)(O[Si](C)(C)C)O[Si](C)(C)C

DOS

IR

Vibrations