Geometry & MOs

Info

ID:	296302
PubChem CID:	117566958
Reduced:	ON2C12H20 (1)
Stoich.:	AB2C12D20 (1)
Weight, g/mol:	220.157563
ΔH_f, kcal/mol:	-36.04
Dipole, Da:	3.34
IP(EA), eV:	-7.7(0.41)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[3-[(3-amino-3-methylbutyl)amino]phenyl]ethanone

Drug info:

PubChemData

Smile

CC(C)(CCNC1=CC=C(C=C1)OC)N

DOS

IR

Vibrations