Geometry & MOs

Info

ID:	445913
PubChem CID:	135269919
Reduced:	ON3H10C11 (2)
Stoich.:	AB3C10D11 (2)
Weight, g/mol:	274.240899
ΔH_f, kcal/mol:	70.05
Dipole, Da:	5.32
IP(EA), eV:	-8.87(-1.49)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-butyl-2,6-dimethyl-4-[(4-methylphenyl)methyl]piperazine

Drug info:

PubChemData

Smile

CC1=NC=C(N=C1C2=NN=C(O2)NC3=CC=CC=C3)C4=CC=C(C=C4)C(=O)N(C)C

DOS

IR

Vibrations