Geometry & MOs

Info

ID:	170621
PubChem CID:	75260005
Reduced:	O2N5C27H37 (1)
Stoich.:	A2B5C27D37 (1)
Weight, g/mol:	337.252941
ΔH_f, kcal/mol:	-29.73
Dipole, Da:	3.89
IP(EA), eV:	-7.87(0.21)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[3-(diethylamino)propylamino]-1-[(3-fluorophenyl)methyl]piperidin-3-ol

Drug info:

PubChemData

Smile

CC(C)(C)C1C2CC(C(=O)NC2N(N1)C3=CC=CC=C3)CNC4=CC=C(C=C4)N5CCOCC5

DOS

IR

Vibrations