Geometry & MOs

Info

ID:	382622
PubChem CID:	134973890
Reduced:	O3C11H16 (1)
Stoich.:	A3B11C16 (1)
Weight, g/mol:	251.115758
ΔH_f, kcal/mol:	-139.63
Dipole, Da:	5.24
IP(EA), eV:	-9.77(-0.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-methyl-2-(3-nitro-2-phenylpropyl)-1,3-dioxolane

Drug info:

PubChemData

Smile

CC1=C(C(=O)C(C1)CCC(=O)OC)C

DOS

IR

Vibrations