Geometry & MOs

Info

ID:	404075
PubChem CID:	135064833
Reduced:	ClO2C13H23 (1)
Stoich.:	AB2C13D23 (1)
Weight, g/mol:	283.157229
ΔH_f, kcal/mol:	-146.43
Dipole, Da:	3.17
IP(EA), eV:	-9.86(0.71)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 2-[[(2-methylphenyl)-(3-methylphenyl)methyl]amino]acetate

Drug info:

PubChemData

Smile

C1CCC(CC1)[C@H]2C[C@H](CC(O2)CCO)Cl

DOS

IR

Vibrations