Geometry & MOs

Info

ID:	256602
PubChem CID:	103140108
Reduced:	BrON2H13C16 (1)
Stoich.:	ABC2D13E16 (1)
Weight, g/mol:	184.157563
ΔH_f, kcal/mol:	38.86
Dipole, Da:	3.6
IP(EA), eV:	-8.21(-0.64)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-methyl-1-[(5-methyloxolan-2-yl)methyl]azetidin-3-amine

Drug info:

PubChemData

Smile

C1=CC(=CC(=C1)Br)COC2=C3C=NC=CC3=C(C=C2)N

DOS

IR

Vibrations