Geometry & MOs

Info

ID:	209788
PubChem CID:	80723009
Reduced:	BrSN4C13H17 (1)
Stoich.:	ABC4D13E17 (1)
Weight, g/mol:	279.231063
ΔH_f, kcal/mol:	45.29
Dipole, Da:	5.2
IP(EA), eV:	-8.86(-1.09)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-N-[3-(diethylamino)propyl]-5-propan-2-yloxybenzene-1,3-diamine

Drug info:

PubChemData

Smile

CC1(CCCS1)CNCC2=CN=C3N2C=C(N=C3)Br

DOS

IR

Vibrations