Geometry & MOs

Info

ID:	264759
PubChem CID:	103489091
Reduced:	NO3C12H25 (1)
Stoich.:	AB3C12D25 (1)
Weight, g/mol:	231.183444
ΔH_f, kcal/mol:	-170.74
Dipole, Da:	3.0
IP(EA), eV:	-9.52(0.78)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-ethoxypropan-2-yl 7-aminoheptanoate

Drug info:

PubChemData

Smile

CCOCC(C)OC(=O)C(CC(C)C)CN

DOS

IR

Vibrations