Geometry & MOs

Info

ID:	259060
PubChem CID:	103158115
Reduced:	NO3C11H23 (1)
Stoich.:	AB3C11D23 (1)
Weight, g/mol:	217.167794
ΔH_f, kcal/mol:	-165.45
Dipole, Da:	2.57
IP(EA), eV:	-9.39(0.73)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

hexyl 4-amino-3-methoxybutanoate

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations