Geometry & MOs

Info

ID:	148797
PubChem CID:	53788466
Reduced:	N2O3C12H20 (1)
Stoich.:	A2B3C12D20 (1)
Weight, g/mol:	437.234177
ΔH_f, kcal/mol:	-157.82
Dipole, Da:	4.13
IP(EA), eV:	-9.82(-0.32)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3R,4S)-4-(4-fluorophenyl)-1-pentyl-3-[[4-(trifluoromethyl)phenyl]methoxymethyl]piperidine

Drug info:

PubChemData

Smile

CC(C)CN1C(=CC(=O)N(C1=O)CC(C)C)O

DOS

IR

Vibrations