Geometry & MOs

Info

ID:	139668
PubChem CID:	52576678
Reduced:	ClO3N4H19C20 (1)
Stoich.:	AB3C4D19E20 (1)
Weight, g/mol:	290.235814
ΔH_f, kcal/mol:	-5.6
Dipole, Da:	1.95
IP(EA), eV:	-8.78(-0.92)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[pentyl(propan-2-yl)amino]-N-[(1R)-1-phenylethyl]acetamide

Drug info:

PubChemData

Smile

C1CN(CCN1C2=CC(=CC=C2)Cl)C(=O)COC3=NN=C(O3)C4=CC=CC=C4

DOS

IR

Vibrations