Geometry & MOs

Info

ID:	125243
PubChem CID:	50916596
Reduced:	NF3O7C19H22 (1)
Stoich.:	AB3C7D19E22 (1)
Weight, g/mol:	216.136159
ΔH_f, kcal/mol:	-426.21
Dipole, Da:	4.89
IP(EA), eV:	-9.34(-0.88)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-methylpropyl 2-(2,2-dimethyl-1,3-dioxolan-4-yl)acetate

Drug info:

PubChemData

Smile

CC1(OCC(O1)CC(=O)CN(C2=C(C=C(C=C2)OC)C(=O)OC)C(=O)C(F)(F)F)C

DOS

IR

Vibrations