Geometry & MOs

Info

ID:	382495
PubChem CID:	134973695
Reduced:	N2O3C18H24 (1)
Stoich.:	A2B3C18D24 (1)
Weight, g/mol:	324.206245
ΔH_f, kcal/mol:	-95.73
Dipole, Da:	5.35
IP(EA), eV:	-8.37(-0.17)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-benzyl-8-(2-methylpropyl)-3,4,5,6,9-pentazatricyclo[7.3.0.02,6]dodeca-2,4-dien-7-imine

Drug info:

PubChemData

Smile

CC(C)C[C@H]1C(=NC2=CC=C(C=C2)OC)OC(=O)C3N1CCC3

DOS

IR

Vibrations