Geometry & MOs

Info

ID:	250451
PubChem CID:	103096744
Reduced:	N2O2C13H16 (1)
Stoich.:	A2B2C13D16 (1)
Weight, g/mol:	341.11028
ΔH_f, kcal/mol:	-36.0
Dipole, Da:	3.56
IP(EA), eV:	-9.05(0.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(2-bromo-5-methoxyphenyl)methyl]-2-(4-methylpiperazin-1-yl)ethanamine

Drug info:

PubChemData

Smile

CCC1=CN=C(O1)CNCC2=CC(=CC=C2)O

DOS

IR

Vibrations