Geometry & MOs

Info

ID:	139576
PubChem CID:	52561317
Reduced:	ClNO2C14H20 (1)
Stoich.:	ABC2D14E20 (1)
Weight, g/mol:	269.118257
ΔH_f, kcal/mol:	-85.45
Dipole, Da:	1.04
IP(EA), eV:	-8.95(-0.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl (2R)-2-[butyl(methyl)amino]-2-(2-chlorophenyl)acetate

Drug info:

PubChemData

Smile

CCCCN(C)[C@@H](C1=CC=CC=C1Cl)C(=O)OC

DOS

IR

Vibrations