Geometry & MOs

Info

ID:	201098
PubChem CID:	79489473
Reduced:	BrFNO2C16H25 (1)
Stoich.:	ABCD2E16F25 (1)
Weight, g/mol:	333.126234
ΔH_f, kcal/mol:	-138.49
Dipole, Da:	4.01
IP(EA), eV:	-8.94(-0.44)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(2,5-dichlorophenyl)-1,1-diethoxy-N-propylpropan-2-amine

Drug info:

PubChemData

Smile

CCCNC(CC1=C(C=C(C=C1)F)Br)C(OCC)OCC

DOS

IR

Vibrations