Geometry & MOs

Info

ID:	258242
PubChem CID:	103152188
Reduced:	ON3C12H21 (1)
Stoich.:	AB3C12D21 (1)
Weight, g/mol:	265.131408
ΔH_f, kcal/mol:	-15.06
Dipole, Da:	4.24
IP(EA), eV:	-9.08(-0.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[(3,5-dimethylbenzoyl)amino]-3-methoxybutanoic acid

Drug info:

PubChemData

Smile

CN(CCC(CN)OC)CC1=CC=NC=C1

DOS

IR

Vibrations