Geometry & MOs

Info

ID:	400098
PubChem CID:	135045423
Reduced:	NO2C14H19 (1)
Stoich.:	AB2C14D19 (1)
Weight, g/mol:	448.12476
ΔH_f, kcal/mol:	-43.65
Dipole, Da:	2.44
IP(EA), eV:	-8.79(0.07)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

None

Drug info:

PubChemData

Smile

CC(C)(C)C1C(=O)CCN(O1)C2=CC=CC=C2

DOS

IR

Vibrations