Geometry & MOs

Info

ID:	197633
PubChem CID:	78983850
Reduced:	ClNO3C14H20 (1)
Stoich.:	ABC3D14E20 (1)
Weight, g/mol:	257.199094
ΔH_f, kcal/mol:	-118.99
Dipole, Da:	2.46
IP(EA), eV:	-9.22(-0.13)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 3-[2-methoxyethyl-(3-methylcyclohexyl)amino]propanoate

Drug info:

PubChemData

Smile

COCCN(CCC(=O)OC)CC1=CC=CC=C1Cl

DOS

IR

Vibrations