Geometry & MOs

Info

ID:	238760
PubChem CID:	93165453
Reduced:	N2O3C17H24 (1)
Stoich.:	A2B3C17D24 (1)
Weight, g/mol:	304.215078
ΔH_f, kcal/mol:	-130.73
Dipole, Da:	5.33
IP(EA), eV:	-9.02(0.19)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[(1R)-2-amino-1-[(2R)-2-methylpiperidin-1-yl]ethyl]-2-methoxy-6-prop-2-enylphenol

Drug info:

PubChemData

Smile

C[C@H](C(=O)O)NC(=O)[C@@H](C(C)C)N1CCC2=CC=CC=C2C1

DOS

IR

Vibrations