Geometry & MOs

Info

ID:	284381
PubChem CID:	104046404
Reduced:	ClNO2C14H18 (1)
Stoich.:	ABC2D14E18 (1)
Weight, g/mol:	265.11365
ΔH_f, kcal/mol:	-60.51
Dipole, Da:	3.91
IP(EA), eV:	-9.43(-0.11)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 2-cyclopropyl-2-(2-phenylsulfanylethylamino)acetate

Drug info:

PubChemData

Smile

CC(C1=CC=CC=C1Cl)NC(C2CC2)C(=O)OC

DOS

IR

Vibrations