Geometry & MOs

Info

ID:	438027
PubChem CID:	135227540
Reduced:	NC14H19 (1)
Stoich.:	AB14C19 (1)
Weight, g/mol:	307.23
ΔH_f, kcal/mol:	7.53
Dipole, Da:	2.24
IP(EA), eV:	-7.95(0.63)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4,12-ditert-butyl-8-methyl-8-azatricyclo[7.4.1.02,7]tetradeca-2(7),3,5,9(14),10,12-hexaene

Drug info:

PubChemData

Smile

CC1CCC2C(C1)C3=CC=CC=C3N2C

DOS

IR

Vibrations