Geometry & MOs

Info

ID:	327214
PubChem CID:	126689235
Reduced:	NO2H15C16 (1)
Stoich.:	AB2C15D16 (1)
Weight, g/mol:	156.11503
ΔH_f, kcal/mol:	-21.73
Dipole, Da:	2.37
IP(EA), eV:	-8.41(-0.53)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-heptyl-2,4-dioxabicyclo[1.1.0]butane

Drug info:

PubChemData

Smile

COC(=O)/C=C/C1=CC=CC=C1NC2=CC=CC=C2

DOS

IR

Vibrations