Geometry & MOs

Info

ID:	246397
PubChem CID:	103059503
Reduced:	ClFON3C14H15 (1)
Stoich.:	ABCD3E14F15 (1)
Weight, g/mol:	354.13068
ΔH_f, kcal/mol:	-33.63
Dipole, Da:	5.39
IP(EA), eV:	-8.98(-0.6)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[[(3-bromophenyl)methyl-methylamino]methyl]-N-propyloxan-4-amine

Drug info:

PubChemData

Smile

CCCNC1=NC=C(N=C1)COC2=C(C(=CC=C2)Cl)F

DOS

IR

Vibrations