Geometry & MOs

Info

ID:	280299
PubChem CID:	103848264
Reduced:	NF2O4C14H19 (1)
Stoich.:	AB2C4D14E19 (1)
Weight, g/mol:	345.05757
ΔH_f, kcal/mol:	-255.23
Dipole, Da:	9.05
IP(EA), eV:	-9.18(-0.54)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[[(2-bromo-4,5-dimethoxyphenyl)methylamino]methyl]oxolan-3-ol

Drug info:

PubChemData

Smile

COC1=CC=CC(=C1OC(F)F)CNCC2(CCOC2)O

DOS

IR

Vibrations