Geometry & MOs

Info

ID:	221953
PubChem CID:	85292952
Reduced:	NO2C12H15 (2)
Stoich.:	AB2C12D15 (2)
Weight, g/mol:	416.194862
ΔH_f, kcal/mol:	-136.43
Dipole, Da:	3.24
IP(EA), eV:	-8.56(-0.11)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

None

Drug info:

PubChemData

Smile

CC1(N(C(C(O1)C2=CC=CC=C2)C=NC3=CC=C(C=C3)OC)C(=O)OC(C)(C)C)C

DOS

IR

Vibrations