Geometry & MOs

Info

ID:	396165
PubChem CID:	135027559
Reduced:	NO2C9H15 (1)
Stoich.:	AB2C9D15 (1)
Weight, g/mol:	395.163377
ΔH_f, kcal/mol:	-74.2
Dipole, Da:	3.66
IP(EA), eV:	-9.88(0.5)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

None

Drug info:

PubChemData

Smile

CC[C@@]12CN1C(COC2=O)(C)C

DOS

IR

Vibrations