Geometry & MOs

Info

ID:	381556
PubChem CID:	134972327
Reduced:	N3H7C11 (1)
Stoich.:	A3B7C11 (1)
Weight, g/mol:	464.231122
ΔH_f, kcal/mol:	104.91
Dipole, Da:	7.09
IP(EA), eV:	-9.17(-1.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(3R,4R,5R,6S)-1-hydroxy-6-methyl-3,4,5-tris(phenylmethoxy)piperidin-2-yl]hydroxylamine

Drug info:

PubChemData

Smile

C1C2=C(C=C(C=C2)C#N)C3=NC=CN31

DOS

IR

Vibrations