Geometry & MOs

Info

ID:	140858
PubChem CID:	52771399
Reduced:	ON6C22H26 (1)
Stoich.:	AB6C22D26 (1)
Weight, g/mol:	322.225643
ΔH_f, kcal/mol:	66.08
Dipole, Da:	6.12
IP(EA), eV:	-8.91(-1.05)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(1S)-1-(4-methoxyphenyl)-2-methylpropyl]-2-[3-methoxypropyl(methyl)amino]acetamide

Drug info:

PubChemData

Smile

C1CCC(CC1)C(=O)N2CCN(CC2)C3=NN4C(=NN=C4C5=CC=CC=C5)C=C3

DOS

IR

Vibrations