Geometry & MOs

Info

ID:	185011
PubChem CID:	77239838
Reduced:	NO4C19H29 (1)
Stoich.:	AB4C19D29 (1)
Weight, g/mol:	547.211147
ΔH_f, kcal/mol:	-117.38
Dipole, Da:	8.9
IP(EA), eV:	-9.64(-0.28)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

None

Drug info:

PubChemData

Smile

CC(C)(C)C(C(=O)O)C1(CC2C1C=C(C2)C3CCCC3)C[N+](=O)[O-]

DOS

IR

Vibrations