Geometry & MOs

Info

ID:	258574
PubChem CID:	103155305
Reduced:	N3O3C13H27 (1)
Stoich.:	A3B3C13D27 (1)
Weight, g/mol:	262.189257
ΔH_f, kcal/mol:	-134.21
Dipole, Da:	2.85
IP(EA), eV:	-9.02(1.13)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-amino-3-methoxy-N-(2-methoxyethyl)-N-(3-methoxypropyl)butanamide

Drug info:

PubChemData

Smile

COCCN1CCCN(CC1)C(=O)CC(CN)OC

DOS

IR

Vibrations