Geometry & MOs

Info

ID:	375386
PubChem CID:	131500165
Reduced:	N2O3C10H14 (1)
Stoich.:	A2B3C10D14 (1)
Weight, g/mol:	317.02766
ΔH_f, kcal/mol:	-53.61
Dipole, Da:	5.4
IP(EA), eV:	-9.32(-1.5)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S)-2-(2-iodo-3-methoxyphenyl)piperidine

Drug info:

PubChemData

Smile

CC1=CC(=C(C(=C1)[N+](=O)[O-])O)C[C@@H](C)N

DOS

IR

Vibrations