Geometry & MOs

Info

ID:

410840

PubChem CID:

135083641

Reduced:

BNOF3C6H12 (1)

Stoich.:

ABCD3E6F12 (1)

Weight, g/mol:

152.08373

ΔHf, kcal/mol:

-268.15

Dipole, Da:

20.21

IP(EA), eV:

0.0(0.0)

Spin(Sz, S2):

0.500000, 0.772307

Charge, e:

0

Chem-info

IUPAC name:

3-(2-methylprop-2-enoxymethyl)furan

Drug info:

PubChemData

Smile

[B-](C(C)CC(=O)N(C)C)(F)(F)F

DOS

IR

Vibrations