Geometry & MOs

Info

ID:	263088
PubChem CID:	103339169
Reduced:	N2O2C13H18 (1)
Stoich.:	A2B2C13D18 (1)
Weight, g/mol:	326.09938
ΔH_f, kcal/mol:	-33.8
Dipole, Da:	6.95
IP(EA), eV:	-8.55(-0.42)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-bromo-N-(2-methoxyethyl)-2-[1-(methylamino)ethyl]-N-prop-2-enylaniline

Drug info:

PubChemData

Smile

CC(=O)C1=NC=C(C=C1)N(CCOC)CC=C

DOS

IR

Vibrations