Geometry & MOs

Info

ID:	212138
PubChem CID:	81059588
Reduced:	N2O2C15H26 (1)
Stoich.:	A2B2C15D26 (1)
Weight, g/mol:	245.162708
ΔH_f, kcal/mol:	-69.91
Dipole, Da:	4.68
IP(EA), eV:	-8.68(0.38)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,2-dimethyl-4-[methyl(2-propan-2-yloxyethyl)amino]-4-oxobutanoic acid

Drug info:

PubChemData

Smile

CCOCCN(C)CCCOC1=CC=CC=C1CN

DOS

IR

Vibrations