Geometry & MOs

Info

ID:	281667
PubChem CID:	103914194
Reduced:	ClN3O3C12H16 (1)
Stoich.:	AB3C3D12E16 (1)
Weight, g/mol:	218.163043
ΔH_f, kcal/mol:	-50.93
Dipole, Da:	3.58
IP(EA), eV:	-9.41(-1.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[2-(2-methoxyethoxy)ethylamino]-3-methylbutanamide

Drug info:

PubChemData

Smile

CC(C)C(C(=O)N)NCC1=C(C=CC(=C1)Cl)[N+](=O)[O-]

DOS

IR

Vibrations