Geometry & MOs

Info

ID:	56783
PubChem CID:	22389681
Reduced:	N3O6H7C8 (1)
Stoich.:	A3B6C7D8 (1)
Weight, g/mol:	297.266779
ΔH_f, kcal/mol:	-65.97
Dipole, Da:	8.44
IP(EA), eV:	-10.79(-1.89)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(dihexylamino)propyl prop-2-enoate

Drug info:

PubChemData

Smile

C1=CC=C(C(=C1)C([N+](=O)[O-])OC(=O)N)[N+](=O)[O-]

DOS

IR

Vibrations