Geometry & MOs

Info

ID:	446613
PubChem CID:	135276388
Reduced:	ON6C21H30 (1)
Stoich.:	AB6C21D30 (1)
Weight, g/mol:	205.146664
ΔH_f, kcal/mol:	-5.93
Dipole, Da:	6.67
IP(EA), eV:	-8.36(-0.68)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(2,6-dimethylphenyl)-2-methyl-2-(methylamino)propan-1-one

Drug info:

PubChemData

Smile

CC1=CC2=C(C=C1C)N3C(=NN=C3C(=N2)NCCCCNC(=O)CC(C)C)C

DOS

IR

Vibrations