Geometry & MOs

Info

ID:	219150
PubChem CID:	85091007
Reduced:	SiN2O4C36H70 (1)
Stoich.:	AB2C4D36E70 (1)
Weight, g/mol:	625.310297
ΔH_f, kcal/mol:	-308.13
Dipole, Da:	3.45
IP(EA), eV:	-8.71(0.71)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[[2,4-bis(trifluoromethyl)phenyl]methyl]-2-[1-[3-[4-(3-piperidin-1-ylpropoxy)phenyl]prop-2-enyl]piperidin-4-yl]acetamide

Drug info:

PubChemData

Smile

CCCCCCC(CCCCCCC=CCCCC1(C(=NC(C(=N1)OCC)C(C)C)OCC)CO)O[Si](C)(C)C(C)(C)C

DOS

IR

Vibrations