Geometry & MOs

Info

ID:	375443
PubChem CID:	131529712
Reduced:	N2H12C13 (1)
Stoich.:	A2B12C13 (1)
Weight, g/mol:	209.105193
ΔH_f, kcal/mol:	69.56
Dipole, Da:	5.38
IP(EA), eV:	-9.15(-1.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl (2S)-2-amino-2-(4-hydroxy-2,6-dimethylphenyl)acetate

Drug info:

PubChemData

Smile

C[C@H](C1=CC=CC2=C1C(=CC=C2)C#N)N

DOS

IR

Vibrations