Geometry & MOs

Info

ID:	282519
PubChem CID:	103928993
Reduced:	ON4C13H28 (1)
Stoich.:	AB4C13D28 (1)
Weight, g/mol:	291.194677
ΔH_f, kcal/mol:	-69.81
Dipole, Da:	3.4
IP(EA), eV:	-8.27(0.96)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2R)-2-amino-1-[4-(2-hydroxyphenyl)piperazin-1-yl]-3,3-dimethylbutan-1-one

Drug info:

PubChemData

Smile

CC(C)(C)[C@H](C(=O)NCCN1CCN(CC1)C)N

DOS

IR

Vibrations