Geometry & MOs

Info

ID:	285065
PubChem CID:	104095016
Reduced:	NO4C11H13 (1)
Stoich.:	AB4C11D13 (1)
Weight, g/mol:	245.162708
ΔH_f, kcal/mol:	-153.6
Dipole, Da:	1.91
IP(EA), eV:	-9.39(-0.99)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[(2-methoxypropanoylamino)methyl]-5-methylhexanoic acid

Drug info:

PubChemData

Smile

CC(C(=O)NC1=CC=CC=C1C(=O)O)OC

DOS

IR

Vibrations