Geometry & MOs

Info

ID:	271002
PubChem CID:	103639947
Reduced:	N2O2C17H30 (1)
Stoich.:	A2B2C17D30 (1)
Weight, g/mol:	316.09504
ΔH_f, kcal/mol:	-71.28
Dipole, Da:	1.76
IP(EA), eV:	-8.45(0.13)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(5-bromo-2-fluorophenyl)methyl]-N'-butan-2-yl-N'-methylethane-1,2-diamine

Drug info:

PubChemData

Smile

CCC(C)N(C)CCNCC1=C(C(=CC=C1)OCC)OC

DOS

IR

Vibrations