Geometry & MOs

Info

ID:	322191
PubChem CID:	126669180
Reduced:	FNO7C14H16 (1)
Stoich.:	ABC7D14E16 (1)
Weight, g/mol:	499.308644
ΔH_f, kcal/mol:	-247.51
Dipole, Da:	4.35
IP(EA), eV:	-9.25(-0.63)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 2-[4-[4-[4-[hydroxy(diphenyl)methyl]piperidin-1-yl]butyl]phenyl]-2-methylpropanoate

Drug info:

PubChemData

Smile

COC1=C(C=C(C=C1)C(C[N+](=O)[O-])C(C(=O)OC)C(=O)OC)F

DOS

IR

Vibrations