Geometry & MOs

Info

ID:	24580
PubChem CID:	611216
Reduced:	ON2C14H14 (1)
Stoich.:	AB2C14D14 (1)
Weight, g/mol:	226.110613
ΔH_f, kcal/mol:	22.63
Dipole, Da:	1.9
IP(EA), eV:	-7.5(-0.33)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

8-methoxy-2,4-dimethyl-2,3-diazatricyclo[7.3.1.05,13]trideca-1(12),3,5(13),6,8,10-hexaene

Drug info:

PubChemData

Smile

CC1=NN(C2=CC=CC3=C(C=CC1=C32)OC)C

DOS

IR

Vibrations