Geometry & MOs

Info

ID:	39230
PubChem CID:	8139953
Reduced:	O2N6C23H28 (1)
Stoich.:	A2B6C23D28 (1)
Weight, g/mol:	354.230728
ΔH_f, kcal/mol:	-25.59
Dipole, Da:	3.81
IP(EA), eV:	-9.22(-0.85)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(4-tert-butylphenoxy)-N-[[2-[(dimethylamino)methyl]phenyl]methyl]acetamide

Drug info:

PubChemData

Smile

CCC(C)(C)[C@@H]1CCC2=NC3=CC=CC=C3C(=C2C1)C(=O)OCC4=NC(=NC(=N4)N)N

DOS

IR

Vibrations