Geometry & MOs

Info

ID:	146908
PubChem CID:	53769939
Reduced:	OC9H10 (2)
Stoich.:	AB9C10 (2)
Weight, g/mol:	304.199822
ΔH_f, kcal/mol:	-64.78
Dipole, Da:	2.5
IP(EA), eV:	-9.3(0.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-nitrotetradecan-4-yl nitrate

Drug info:

PubChemData

Smile

CC(C1=CC=CC=C1)C2=CC(=CC=C2)C(C)OC(=O)C

DOS

IR

Vibrations